0  B13R2.369  CC1=NC2=C(C=CC=C2)NC1=O XBX00029 [0,0,0,0,0,0|3,0,0]=3
1  B13R2.369  CC1=NC2=CC=CC=C2N=C1O RF02078 [0,0,0,0,0,0|3,0,1]=4
2  B13R2.369  OC1=C(O)N=C2C=CC=CC2=N1 MGH00027 [0,0,0,0,0,0|2,0,2]=4
3  B13R2.369  OC1=NC2=C(N=CC=C2)N=C1O BTB09826 [0,0,0,0,0,0|1,0,2]=3
4  B12R2.24  ClC1=CC2=C(C=C1)N=CC=C2 AC31488 [1,0,0,0,0,0|2,0,0]=3
5  B12R2.24  O=C1CSC2=C(C=CC=C2)N1 RB00326 [1,0,0,0,0,0|2,0,1]=4
6  B14R2.1128  N#CC1=CC2=C(C=CC=C2)OC1=O BTB01247 [0,1,0,0,0,0|3,0,0]=4
7  B14R2.8188  CC1=NC2=CC=CC=C2N(C)C1=O SEW00767 [0,1,0,0,0,0|3,0,0]=4
8  B14R2.8188  O=C1NC2=CC=CC=C2C(O)=C1Br RJC01448 [0,1,0,0,0,0|2,0,0]=3
9  B14R2.8239  O=C1NC2=CC=C(Cl)C=C2NC1=O BTB09743 [0,1,0,0,0,0|2,0,1]=4
10  B11R1.40  O=C(NO)NC1=CC=CC=C1 JFD01119 [1,0,1,0,0,0|2,0,0]=4
11  B11R1.91  NC(=O)NCC1=NC=CC=C1 BTB05401 [1,0,1,0,0,0|1,0,1]=4
12  B13R1.135  C\C(=N/O)C(=O)NC1=CC=CC=C1 BTBG00175 [0,1,1,0,0,0|1,0,1]=4
13  B13R1.418  N#C\C(=C/C1=CC=CC=C1)C(N)=O BTB09600 [0,1,1,0,0,0|2,0,0]=4
14  B13R1.418  N#C\C(=C/C1=NC=CC=C1)C(N)=O RB00244 [0,1,1,0,0,0|1,0,0]=3
15  B13R1.470  O=C(\C=N\O)NC1=C(Cl)C=CC=C1 JA00163 [0,1,1,0,0,0|2,0,0]=4
16  B13R2.328  O=C1NC(=O)C2=CC=CC=C2N1 JFD03657 [1,1,0,0,0,0|2,0,0]=4
17  B13R2.3683  CC1=CC=C2C=C(F)C=CC2=N1 BTB02593 [1,1,0,0,0,0|2,0,0]=4
18  B13R2.3683  CC1=CC=C2OC(=O)C=CC2=C1 SB00764 [1,1,0,0,0,0|2,0,0]=4
19  B13R2.3683  CC1=NC2=CC=C(Cl)C=C2C=C1 RJC01119 [1,1,0,0,0,0|2,0,0]=4
20  B13R2.45  O=C1C2=CC=CC=C2C\C1=C/O FM00016 [0,1,0,0,1,0|1,0,1]=4
21  B13R2.135  N\N=C1/C(=O)NC2=CC=CC=C21 RH00963 [0,1,0,0,1,0|2,0,0]=4
22  B13R2.135  O=C1NC2=CC=CC=C2\C1=N\O BTB09934 [0,1,0,0,1,0|1,0,0]=3
23  B13R2.3028  CC1=CC2=C(C=C1)NC(=O)C2=O JA00002 [0,1,0,0,1,0|1,0,1]=4
24  B13R2.3028  O=C1NC2=C(C=C(Br)C=C2)C1O CD07798 [0,1,0,0,1,0|1,0,1]=4
25  B13R2.3028  O=C1NC2=CC=C(Cl)C=C2C1=O RH00683 [0,1,0,0,1,0|1,0,1]=4
26  B13R2.3028  O=C1NC2=CC=C(F)C=C2C1=O BTB01627 [0,1,0,0,1,0|1,0,1]=4
27  B13R2.3028  O=C1NC2=CC=C(F)C=C2C1O SEW05246 [0,1,0,0,1,0|1,0,1]=4
28  B13R2.3085  O=C1C2=CC=CC=C2C(=O)N1O S04335 [0,1,0,0,1,0|2,0,0]=4
29  B15R2.274  CC1=C(C#N)C(=O)NC2=CC=CC=C21 SPB07716 [0,2,0,0,0,0|2,0,0]=4
30  B15R2.274  CCC1=C(O)C2=CC=CC=C2NC1=O RJC01476 [0,2,0,0,0,0|2,0,0]=4
31  B15R2.274  N#CC1=C(O)C2=CC=CC=C2NC1=O BTB12479 [0,2,0,0,0,0|2,0,0]=4
32  B15R2.984  O=C(O)C1=CC2=C(C=CC=C2)OC1=O BTB01252 [0,2,0,0,0,0|2,0,0]=4
33  B15R2.9032  CC1=C(O)C2=CC=CC=C2N(C)C1=O RJC03345 [0,2,0,0,0,0|2,0,0]=4
34  B15R2.9032  CN1C(=O)C(I)=C(O)C2=CC=CC=C21 NRB05093 [0,2,0,0,0,0|2,0,0]=4
35  B13R2.435  O=C(O)C1=CC2=C(C=CC=C2)O1 CC06601 [0,0,1,1,0,0|2,0,0]=4