0  B17R2.68  COC1=CC=C(C(=O)C2=CN=CC=C2)C=C1 8051AD [1,0,0,0,0,0|1,0,0]=2
1  B17R2.68  COC1=NC=C(C(=O)C2=CC=CC=N2)C=C1 2069AE [1,0,0,0,0,0|2,0,0]=3
2  B17R2.68  N#CC1=CC=C(C(=O)C2=NC=CC=C2)C=C1 5979AE [1,0,0,0,0,0|3,0,0]=4
3  B19R2.241  COC1=CC(O)=C(C(=O)C2=CC=CC=C2)C(O)=C1 W2024 [0,1,0,0,0,0|0,0,0]=1
4  B19R2.1018  COC1=C(Br)C=C(C(=O)C2=CC=CC=C2)C(O)=C1 3719AB [0,1,0,0,0,0|0,0,0]=1
5  B16R2.120  O=C(C1=CC=C(I)C=C1)C2=NC=CC=C2 2515AF [2,0,0,0,0,0|2,0,0]=4
6  B16R2.120  O=C(C1=CC=CC=C1)C2=CC=C(Br)C=N2 0580AB [2,0,0,0,0,0|2,0,0]=4
7  B16R2.3896  NC1=C(C(=O)C2=CC=CC=C2)C=CN=C1 4905AB [2,0,0,0,0,0|2,0,0]=4
8  B16R2.3896  O=C(C1=CC=CC=C1)C2=C(O)N=CC=C2 8510AH [2,0,0,0,0,0|1,0,0]=3
9  B16R2.3896  O=C(C1=NC=CC=C1)C2=C(Br)C=CC=C2 9356AE [2,0,0,0,0,0|2,0,0]=4
10  B18R2.99  COC1=CC=C(C(N)C2=CC=C(Cl)C=C2)C=C1 1427AL [1,1,0,0,0,0|1,0,1]=4
11  B20R2.309440  N#CC1=CC=C(C(=O)C2=CC=C(F)C=C2)C(CO)=C1 W4939 [0,2,0,0,0,0|2,0,0]=4
12  B18R2.9375  COC(=O)C1=CC(C(=O)C2=CC=CC=C2)=CN1 1025AE [0,0,1,1,0,0|2,0,0]=4
13  B20R3.42232  COC1=CC2=C(C=C1)N=C(C3=CC=CC=C3)C=C2 6556AB [0,0,0,1,0,1|2,0,0]=4
14  B20R3.486012  COC1=CC2=C(C=C1)C(=O)C3=C(C=CC=C3)CC2 1768AJ [0,1,0,1,0,0|1,0,0]=3
15  B16R2.46  COC1=CC=C(C(=O)C2=NC=CN2)C=C1 Y9807 [1,0,0,0,1,0|2,0,0]=4
16  B16R2.46  COC1=CC=C(C(=O)C2=NC=CO2)C=C1 2442AF [1,0,0,0,1,0|2,0,0]=4
17  B18R2.57  COC1=CC=C(\C=[N+](/[O-])C2=CC=CC=C2)C=C1 0086AQ [1,0,0,0,0,1|1,0,1]=4
18  B18R2.57  COC1=CC=C(\N=C(/C)C2=CC=CC=C2)C=C1 0107AQ [1,0,0,0,0,1|1,0,0]=3
19  B18R2.57  N#CC1=CC=C(CC(=O)C2=CC=CC=C2)C=C1 6442AE [1,0,0,0,0,1|2,0,0]=4
20  B18R2.81  NCC1=CC=C(C(=O)CC2=CC=CC=C2)C=C1 9453AH [1,0,0,0,0,1|2,0,0]=4
21  B18R2.6540  CC1=CC(N)=CC=C1NC(=O)C2=CC=CC=C2 7998AC [1,0,0,0,0,1|2,0,0]=4