0  B13R2.162  ClC1=CC2=C(C=CN=C2C=C1)Br BBO000279 [1,0,0,0,0,0|3,0,0]=4
1  B13R2.162  FC1=CC=C2N=CC=C(C2=C1)Br BBO000278 [1,0,0,0,0,0|3,0,0]=4
2  B13R2.162  O=C1C=CC2=C(N1)C(=CN=C2)Br VBP00003 [1,0,0,0,0,0|3,0,0]=4
3  B13R2.162  O=C1C=CC2=CC=CC(=C2N1)Br KOB0160 [1,0,0,0,0,0|2,0,0]=3
4  B13R2.369  CC1NC2=C(C=CC=C2)NC1=O R227021 [1,0,0,0,0,0|2,0,1]=4
5  B13R2.369  N=C1NC2=CC=CC=C2OC1=O T319554 [1,0,0,0,0,0|3,0,0]=4
6  B13R2.369  S=C1NC2=C(C=CC=C2)NC1=S PH008919 [1,0,0,0,0,0|1,2,0]=4
7  B13R2.5179  CC1=CC2=NC=CC(=C2C=C1)Br BBO000588 [1,0,0,0,0,0|3,0,0]=4
8  B13R2.5179  FC1=CC2=NC=CC(=C2C=C1)Br BBO000589 [1,0,0,0,0,0|3,0,0]=4
9  B13R2.4825  CC1=CC=CC2=C1NC(=O)C2=O S639125 [0,0,0,0,1,0|2,0,0]=3
10  B13R2.4856  N1C(=O)C(=O)C2=C1C=CC=C2Cl S337161 [0,0,0,0,1,0|1,1,0]=3
11  B13R2.4856  O=C1NC2=C(C1=O)C(=CC=C2)Br PH016095 [0,0,0,0,1,0|1,0,0]=2
12  B13R2.4856  O=C1NC2=C(C1=O)C(=CC=C2)F CDS020844 [0,0,0,0,1,0|1,1,0]=3
13  B12R2.24  O=C1CNC2=CC=CC=C2N1 T324280 [2,0,0,0,0,0|1,0,1]=4
14  B12R2.24  O=C1COC2=NC=CC=C2N1 ADE001249 [2,0,0,0,0,0|1,0,1]=4
15  B12R2.24  O=C1CSC2=NC=CC=C2N1 PH011261 [2,0,0,0,0,0|1,0,1]=4
16  B14R1.135  CC1=CC=CC(=C1)NC(=O)C(=O)NN TMT00017 [0,1,1,0,0,0|2,0,0]=4
17  B14R2.8188  CN1C(=O)C(=O)NC2=CC=CC=C12 CBR00312 [1,1,0,0,0,0|1,0,0]=3
18  B14R2.8239  CC1=CC=C2NC(=O)C(=O)NC2=C1 CDS019918 [1,1,0,0,0,0|1,0,0]=3
19  B14R2.8239  O=C1NC2=C(C=C(C=C2)Cl)NC1=O PH003527 [1,1,0,0,0,0|1,0,0]=3
20  B14R2.29365  O=C1COC2=C(C=C(N=C2N1)Br)Br ADE001307 [1,1,0,0,0,0|1,0,1]=4
21  B14R2.8620  CC1=CC=C(C2=C1NC(=O)C2=O)C S17567 [0,1,0,0,1,0|2,0,0]=4
22  B14R2.9184  CC1=C2NC(=O)C(=O)C2=CC(=C1)Br TMT00014 [0,1,0,0,1,0|2,0,0]=4
23  B14R2.9184  CC1=CC(=C2NC(=O)C(=O)C2=C1)Br OTV000673 [0,1,0,0,1,0|1,0,0]=3
24  B14R2.11645  COC1=CC=CC2=C1NC(=O)C2=O R162574 [0,1,0,0,1,0|2,0,0]=4
25  B14R2.4506  N1C(=O)C(=O)C2=C1C=CC(=C2Cl)Cl S53881 [0,1,0,0,1,0|1,1,0]=4
26  B14R2.27750  O=C1NC2=C(C1=O)C(=CC(=C2)Cl)Cl PH011218 [0,1,0,0,1,0|1,1,0]=4
27  B12R2.202  O=C1CC2=C(C=CN=C2N1)Cl CDS023561 [1,0,0,0,1,0|1,1,0]=4
28  B12R2.203  ClC1=C2C(=CNC2=NC=C1)Br SYX00215 [1,0,0,0,1,0|1,1,0]=4
29  B12R2.203  ClC1=C2C(=CNC2=NC=C1)I ADE000946 [1,0,0,0,1,0|1,1,0]=4
30  B12R2.18  CC1=C(C2=CC=CN=C2N1)I PHB00180 [1,0,0,0,1,0|2,0,0]=4
31  B12R2.100  O=C1NC2=COC=C2NC1=O R463760 [1,0,0,0,1,0|1,0,0]=3
32  B12R2.196  CC1=CNC2=C(C=CC=C12)Br T117943 [1,0,0,0,1,0|2,0,0]=4
33  B14R1.5978  CC(=O)CC(=O)NC1=CC(=CC=N1)C S563676 [0,0,1,0,0,1|2,0,0]=4