0  B21R3.44601948  CCOC1=CC2=C(C3=C(C=C(C=C3)N)N=C2C=C1)N MCULE-4995976057 [0,0,0,0,0,0|0,0,2]=2
1  B21R3.44601948  CCOC1=CC2=C(C=C1)N=C3C=C(C=CC3=C2N)Cl MCULE-3011947655 [0,0,0,0,0,0|1,0,2]=3
2  B21R3.44601948  CCOC1=CC2=C(C=C1)N=C3C=C(C=CC3=C2O)N MCULE-5817525308 [0,0,0,0,0,0|1,0,1]=2
3  B20R3.165135  CCOC1=CC2=C(C=C1)NC3=C(C2=O)C=CC=N3 MCULE-6910484620 [1,0,0,0,0,0|2,0,0]=3
4  B20R3.9102164  COC1=CC2=C(C3=CC=C(C=C3N=C2C=C1)Cl)Cl MCULE-7428686609 [1,0,0,0,0,0|2,0,1]=4
5  B20R3.9102164  COC1=CC2=C(C=C1)N=C3C=C(C=CC3=C2N)Cl MCULE-6682662373 [1,0,0,0,0,0|1,0,2]=4
6  B20R3.9102164  COC1=CC2=C(C=C1)NC3=C(C2=O)C=CC(=C3)Cl MCULE-2482387505 [1,0,0,0,0,0|2,0,0]=3
7  B19R2.47080  CCOC1=CC=C(C=C1)NC2=CC(=O)C=CC2=O MCULE-2375448867 [1,0,1,0,0,0|2,0,0]=4
8  B19R2.117818  CCOC1=CC(=CC=C1)OC2=CC=C(C=C2C)N MCULE-4368586525 [1,0,1,0,0,0|2,0,0]=4
9  B19R2.117818  CCOC1=CC(=CC=C1)OC2=CC=C(C=C2Cl)N MCULE-3480688721 [1,0,1,0,0,0|2,0,0]=4
10  B19R2.117818  CCOC1=CC=CC(=C1)OC2=C(C=C(C=C2)Br)N MCULE-9355621264 [1,0,1,0,0,0|2,0,0]=4
11  B19R2.117818  CCOC1=CC=CC(=C1)OC2=C(C=C(C=C2)C)N MCULE-4309528158 [1,0,1,0,0,0|2,0,0]=4
12  B19R2.117818  CCOC1=CC=CC(=C1)OC2=C(C=C(C=C2)Cl)N MCULE-7436499628 [1,0,1,0,0,0|2,0,0]=4
13  B19R2.117818  CCOC1=CC=CC(=C1)OC2=C(C=C(C=C2)F)N MCULE-2372865304 [1,0,1,0,0,0|2,0,0]=4
14  B19R2.117818  CCOC1=CC=CC(=C1)OC2=C(C=C(C=C2)N)F MCULE-9322948639 [1,0,1,0,0,0|2,0,0]=4
15  B19R2.9582  CCOC1=CC=C(C(=C1)C(=O)C2=CC=CC=C2)O MCULE-1699343874 [1,0,1,0,0,0|2,0,0]=4
16  B19R2.195436  COC1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Cl)N MCULE-9741774766 [1,0,1,0,0,0|2,0,0]=4
17  B19R3.306295  CCC1=CC2=C(C=C1)SC3=C(C2=O)C=CC=C3 MCULE-2770080102 [2,0,0,0,0,0|2,0,0]=4
18  B19R3.306295  COC1=CC2=C(C3=C(C=CC=C3)N=C2C=C1)Cl MCULE-5982133470 [2,0,0,0,0,0|1,0,1]=4
19  B19R3.306295  COC1=CC2=C(C=C1)N=C3C=CC=CC3=C2N MCULE-3586216850 [2,0,0,0,0,0|0,0,2]=4
20  B19R3.306295  COC1=CC2=C(C=C1)NC3=CC=CC=C3C2=O MCULE-4552310688 [2,0,0,0,0,0|1,0,0]=3
21  B19R3.306295  COC1=CC2=C(C=C1)OC3=CC=CC=C3C2=O MCULE-3699412924 [2,0,0,0,0,0|2,0,0]=4
22  B19R3.306295  COC1=CC2=C(C=C1)SC3=CC=CC=C3C2=O MCULE-8456889725 [2,0,0,0,0,0|2,0,0]=4
23  B21R3.62071007  COC1=CC=C2NC3=C(C=CC(=C3C)C)C(=O)C2=C1 MCULE-2624499386 [1,1,0,0,0,0|2,0,0]=4
24  B23R3.155191214  CCOC1=CC2=C(C=C1)NC3=CC(=CC=C3C2=O)N(=O)=O MCULE-6503412025 [0,2,0,0,0,0|1,0,1]=4
25  B21R2.270782  CCOC1=CC(=CC=C1)C(=O)NC2=CC=C(C=C2C)N MCULE-9054347760 [0,0,1,0,0,1|2,0,0]=4