0  B18R2.3368  N#CC1=C(SN=C1Cl)NCCC2=CC=CC=C2 MCULE-6724731175 [0,0,0,0,0,0|0,0,0]=0
1  B18R2.3368  N#CC1=C(SN=C1Cl)NN=CC2=CC=CC=C2 MCULE-5009977670 [0,0,0,0,0,0|1,0,1]=2
2  B17R2.1085  N#CC1=C(OC=N1)NCCC2=CC=CC=C2 MCULE-6339730667 [1,0,0,0,0,0|2,1,0]=4
3  B19R2.3720  CC1=NSC(=C1C#N)NC(=O)OC2=CC=CC=C2 MCULE-7653329818 [0,1,0,0,0,0|2,0,1]=4
4  B19R2.28598  COC1=NSC(=C1C#N)N/N=C/C2=CC=CC=C2 MCULE-3276137233 [0,1,0,0,0,0|2,0,1]=4
5  B19R2.28598  COC1=NSC(=C1C#N)NN=CC2=CC=CC=C2 MCULE-9078302094 [0,1,0,0,0,0|2,0,1]=4
6  B19R2.28598  CSC1=NSC(=C1C#N)N/N=C/C2=CC=CC=C2 MCULE-4732065343 [0,1,0,0,0,0|2,0,1]=4
7  B19R2.28598  CSC1=NSC(=C1C#N)NN=CC2=CC=CC=C2 MCULE-7717598646 [0,1,0,0,0,0|2,0,1]=4
8  B17R1.2689  CC(=C(C#N)C(=O)N)NCCC1=CC=CC=C1 MCULE-7207936974 [0,0,1,0,0,0|2,0,1]=4
9  B16R1.3018  N#CC(=CNCCC1=CC=CC=C1)C(=O)N MCULE-7772416565 [1,0,1,0,0,0|1,0,1]=4
10  B18R2.3229  N#CC1=C(SC=C1)NC(=O)CC2=CC=CC=C2 MCULE-3677450920 [1,1,0,0,0,0|1,0,1]=4
11  B18R2.3366  N#CC1=C(SN=C1Cl)NC(=O)C2=CC=CC=C2 MCULE-6188792037 [0,1,0,0,1,0|0,0,1]=3
12  B20R2.56913  N#CC1=C(C=CC=C1Cl)NCCC2=CC=C(C=C2)Cl MCULE-8222243619 [0,1,0,0,0,1|2,0,0]=4
13  B20R2.6108  COC1=CC=C(C=C1)CCNC2=C(C(=NS2)Cl)C#N MCULE-6605688887 [0,2,0,0,0,0|0,0,0]=2
14  B16R2.169  N#CC1=C(NN=C1)NCC2=CN=CC=C2 MCULE-4905321075 [1,0,0,0,1,0|2,0,0]=4
15  B16R2.28  N#CC1=C(SN=C1O)NC2=CC=CC=C2 MCULE-9694822584 [0,0,0,0,2,0|1,0,0]=3