0  B13R2.3683  BrC1=CC2=CC=C(I)C=C2N=C1 ACI-06631 [0,0,0,0,0,0|3,0,0]=3
1  B13R2.3683  NC1=CC=C2C=C(Br)C=NC2=C1 ACI-06630 [0,0,0,0,0,0|3,0,0]=3
2  B13R2.3683  NC1=NC=C2C=C(Br)C=CC2=N1 ACI-05238 [0,0,0,0,0,0|4,0,0]=4
3  B12R2.24  O=C1CNC2=CC=CC=C2O1 ACI-02216 [1,0,0,0,0,0|2,0,1]=4
4  B12R2.24  O=C1NC2=CC=CC=C2CO1 ACI-02206 [1,0,0,0,0,0|2,0,1]=4
5  B12R2.24  O=C1NCC2=CC=CC=C2O1 ACI-02210 [1,0,0,0,0,0|2,0,1]=4
6  B12R2.24  OC1=CN=C2C=CC=CC2=N1 ACI-01320 [1,0,0,0,0,0|2,0,1]=4
7  B14R2.8235  O=C1C=C(O)C2=C(C=CC(Br)=C2)N1 ACI-04871 [0,1,0,0,0,0|2,0,0]=3
8  B12R1.226  CC(=O)\C=C\C1=CC(Br)=CC=C1 ACI-00860 [0,0,1,0,0,0|1,0,1]=3
9  B12R1.226  CC(=O)\C=C\C1=CC(Cl)=CC=C1 ACI-01676 [0,0,1,0,0,0|1,0,1]=3
10  B12R1.226  CC1=CC(\C=C\C(=O)O)=CC=C1 ACI-05911 [0,0,1,0,0,0|2,0,0]=3
11  B12R1.226  O=C(O)\C=C\C1=CC=CC(Cl)=C1 ACI-05908 [0,0,1,0,0,0|2,0,0]=3
12  B12R1.226  O=C(O)\C=C\C1=CC=CC(F)=C1 ACI-05914 [0,0,1,0,0,0|2,0,0]=3
13  B12R2.606  NC1=CC=C2NC(=O)OC2=C1 ACI-02618 [0,0,0,0,1,0|3,0,0]=4
14  B12R2.612  CN1C=CC2=C1C=CC(Br)=C2 JM-07I-001 [0,0,0,0,1,0|3,0,0]=4
15  B11R1.91  O=C(O)\C=C\C1=CC=NC=C1 ACI-01372 [1,0,1,0,0,0|2,0,0]=4
16  B13R1.3420  O=C(O)\C=C\C1=CC(F)=CC(F)=C1 ACI-05920 [0,1,1,0,0,0|2,0,0]=4
17  B13R2.57  ClCC1=NC2=CC=CC=C2C=C1 ACI-03793 [1,1,0,0,0,0|2,0,0]=4
18  B13R2.57  N#CC1=NC2=CC=CC=C2C=C1 ACI-05181 [1,1,0,0,0,0|2,0,0]=4
19  B13R2.57  O=CC1=CC2=CC=CN=C2C=C1 ACI-05343 [1,1,0,0,0,0|1,0,0]=3
20  B13R2.57  O=CC1=NC2=CC=CC=C2N=C1 SB-05K-001 [1,1,0,0,0,0|2,0,0]=4
21  B13R2.57  OCC1=CC2=CC=CN=C2C=C1 ACI-05342 [1,1,0,0,0,0|1,0,1]=4
22  B13R2.155  NC1=CC=C2C=CC(=O)NC2=C1 FD-11C-001 [1,1,0,0,0,0|1,0,0]=3
23  B13R2.328  CC1=CC(Cl)=C2C=CC=CC2=N1 ACI-01333 [1,1,0,0,0,0|2,0,0]=4
24  B13R2.328  ClC1=CC(Cl)=C2C=CC=CC2=N1 ACI-00807 [1,1,0,0,0,0|2,0,0]=4
25  B13R2.43  CC1=CC2=C(C=C1)SC(C=O)=C2 ACI-02137 [0,1,0,0,1,0|2,0,0]=4
26  B13R2.43  O=CC1=CC2=C(C=C(Br)C=C2)S1 ACI-01068 [0,1,0,0,1,0|2,0,0]=4
27  B13R2.43  O=CC1=CC2=C(C=C(F)C=C2)S1 ACI-02135 [0,1,0,0,1,0|2,0,0]=4
28  B13R2.43  O=CC1=CC2=C(C=CC(Br)=C2)S1 ACI-01072 [0,1,0,0,1,0|2,0,0]=4
29  B13R2.2130  CN1C=CC2=C1C=CC(C=O)=C2 ACI-02305 [0,1,0,0,1,0|2,0,0]=4
30  B15R2.7180  O=[N+]([O-])C1=CC=C2C=C(Br)C=NC2=C1 ACI-06629 [0,2,0,0,0,0|2,0,0]=4
31  B11R2.1  BrC1=CSC2=C1C=CC=C2 ACI-00699 [1,0,0,0,1,0|2,0,0]=4
32  B11R2.1  CC1=COC2=C1C=CC=C2 ACI-01521 [1,0,0,0,1,0|2,0,0]=4
33  B11R2.1  CC1=CSC2=C1C=CC=C2 ACI-02476 [1,0,0,0,1,0|2,0,0]=4
34  B11R2.36  NC1=CC2=C(C=C1)OC=C2 ACI-05788 [1,0,0,0,1,0|2,0,0]=4
35  B11R2.36  OC1=CC2=C(C=C1)OC=C2 ACI-05787 [1,0,0,0,1,0|1,0,1]=4