0  B21R3.27603058  CN1C(=O)C2=C(N=CN2CC3OCCO3)N(C1=O)C MCULE-4193802883 [0,0,0,0,0,0|0,0,0]=0
1  B21R3.27603058  CN1C(=O)C2=C(N=CN2CC3SCCS3)N(C1=O)C MCULE-1734144901 [0,0,0,0,0,0|0,2,0]=2
2  B20R2.1073131  CCNC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C MCULE-8439921103 [0,0,1,0,0,0|1,0,2]=4
3  B20R2.1073131  CCOC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C MCULE-1555644606 [0,0,1,0,0,0|0,0,2]=3
4  B22R3.6814528  CN1C(=O)C2=C(NCN(C2)CC3CCCO3)N(C1=O)C MCULE-6629617241 [0,0,0,0,0,1|1,0,2]=4
5  B22R3.50326533  CN1C(=O)C2=C(N=CN2CN3CCCCC3)N(C1=O)C MCULE-6465626694 [0,0,0,0,0,1|3,0,0]=4
6  B19R2.1351780  CN1C(=O)C2=C(N=CN2CC(O)CCl)N(C1=O)C MCULE-2357243743 [1,0,1,0,0,0|1,0,0]=3
7  B19R2.1351780  CN1C(=O)C2=C(N=CN2CC(O)CO)N(C1=O)C MCULE-5509227834 [1,0,1,0,0,0|1,0,0]=3
8  B19R2.1351780  COC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C MCULE-2830736533 [1,0,1,0,0,0|0,0,2]=4
9  B19R2.1046181  C=COCCN1C=NC2=C1C(=O)N(C(=O)N2C)C MCULE-9295278539 [1,0,1,0,0,0|0,0,2]=4
10  B19R2.1046181  CCCCCN1C=NC2=C1C(=O)N(C(=O)N2C)C MCULE-1592880287 [1,0,1,0,0,0|1,0,0]=3
11  B19R2.1046181  CN1C(=O)C2=C(N=CN2CCCC#N)N(C1=O)C MCULE-9934333525 [1,0,1,0,0,0|1,0,1]=4
12  B19R2.1183185  CCOC(=O)CN1C=NC2=C1C(=O)NC(=O)N2C MCULE-3383096929 [1,0,1,0,0,0|0,0,2]=4
13  B21R2.5280089  CCOC(=O)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)Br MCULE-8190221356 [0,1,1,0,0,0|0,0,2]=4
14  B21R2.5280089  CCOC(=O)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)Cl MCULE-8744496032 [0,1,1,0,0,0|0,0,2]=4
15  B21R2.8023552  CCOC(=O)C(C)N1C=NC2=C1C(=O)N(C(=O)N2C)C MCULE-6861082230 [0,1,1,0,0,0|0,0,2]=4
16  B21R2.1170306  CC(CO)NCCN1C=NC2=C1C(=O)N(C(=O)N2C)C MCULE-6662922655 [0,1,1,0,0,0|1,0,0]=3
17  B21R2.3187886  CCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)Br MCULE-1128864296 [0,1,1,0,0,0|2,0,0]=4
18  B21R2.3187886  CCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)S MCULE-3101927324 [0,1,1,0,0,0|2,0,0]=4
19  B21R3.5177645  CCCN1CCN2C1=NC3=C2C(=O)N(C(=O)N3C)C MCULE-9576381889 [0,0,1,1,0,0|2,0,0]=4
20  B21R3.5177645  CN1C(=O)C2=C(N=C3N2CCN3CCO)N(C1=O)C MCULE-2307288564 [0,0,1,1,0,0|1,0,0]=3
21  B19R3.23088863  CN1C(=O)C2=C(N=CN2CC3CC3)N(C1=O)C MCULE-6555036964 [0,0,0,0,2,0|0,0,0]=2
22  B23R3.476041315  CN1C(=O)C2=C(N=CC=C2NCC3CCCO3)N(C1=O)C MCULE-5545586392 [0,0,0,0,0,2|2,0,0]=4