0  B17R2.18706  O=C1CCC(N1)C(=O)N2CSCC2C(=O)O MCULE-3374254585 [0,0,0,0,0,0|0,0,0]=0
1  B17R2.18706  O=C1CC[C@H](N1)C(=O)N2CSC[C@@H]2C(=O)O MCULE-3188252851 [0,0,0,0,0,0|0,0,0]=0
2  B17R2.18706  O=C1CC[C@H](N1)C(=O)N2CSC[C@@H]2C(=O)O MCULE-3543184304 [0,0,0,0,0,0|0,0,0]=0
3  B17R2.18706  O=C1CC[C@H](N1)C(=O)N2CSC[C@H]2C(=O)O MCULE-4298342530 [0,0,0,0,0,0|0,0,0]=0
4  B17R2.18706  O=C1CC[C@H](N1)C(=O)N2CSC[C@H]2C(=O)O MCULE-8730505009 [0,0,0,0,0,0|0,0,0]=0
5  B16R2.508  O=C(O)C1CCCN1C(=O)C2CCCC2 MCULE-4204821037 [1,0,0,0,0,0|2,0,1]=4
6  B16R2.508  O=C(O)C1CCCN1C(=O)C2CCCN2 MCULE-1865023679 [1,0,0,0,0,0|1,0,1]=3
7  B16R2.508  O=C(O)C1CCCN1C(=O)C2CCCN2 MCULE-8480713608 [1,0,0,0,0,0|1,0,1]=3
8  B16R2.508  O=C(O)[C@@H]1CCCN1C(=O)[C@@H]2CCCN2 MCULE-6548203105 [1,0,0,0,0,0|1,0,1]=3
9  B16R2.508  O=C(O)[C@@H]1CCCN1C(=O)[C@@H]2CCCN2 MCULE-7975808983 [1,0,0,0,0,0|1,0,1]=3
10  B16R2.508  O=C(O)[C@@H]1CCCN1C(=O)[C@@H]2CCCN2 MCULE-8653778882 [1,0,0,0,0,0|1,0,1]=3
11  B16R2.508  O=C(O)[C@@H]1CCCN1C(=O)[C@@H]2CCCN2 MCULE-9758812499 [1,0,0,0,0,0|1,0,1]=3
12  B16R2.508  O=C(O)[C@@H]1CSCN1C(=O)C2CCCC2 MCULE-3485088338 [1,0,0,0,0,0|1,0,1]=3
13  B16R1.7455  NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)O MCULE-7071949160 [0,0,1,0,0,0|2,0,0]=3
14  B15R1.3932  CC(=O)NCC(=O)N1CCCC1C(=O)O MCULE-4128564537 [1,0,1,0,0,0|1,0,0]=3
15  B17R1.34039  CC(C)C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)O MCULE-3737395417 [0,1,1,0,0,0|1,0,0]=3
16  B17R1.16594  CC(N)C(=O)NCC(=O)N1CCCC1C(=O)O MCULE-6661447945 [0,1,1,0,0,0|1,0,0]=3
17  B17R2.19339  O=C(O)C1CC(CN1C(=O)C2CCCN2)O MCULE-1818604836 [1,1,0,0,0,0|1,0,1]=4
18  B17R2.19339  O=C(O)[C@@H]1C[C@H](CN1C(=O)[C@@H]2CCCN2)O MCULE-5873687213 [1,1,0,0,0,0|1,0,1]=4
19  B17R2.19339  O=C(O)[C@@H]1C[C@H](CN1C(=O)[C@@H]2CCCN2)O MCULE-6230778246 [1,1,0,0,0,0|1,0,1]=4
20  B15R2.69584  O=C(O)C1CCCN1C(=O)C2CCC2 MCULE-2073146874 [1,0,0,0,1,0|1,0,1]=4
21  B15R2.69584  O=C(O)C1CSCN1C(=O)C2CCC2 MCULE-8549346067 [1,0,0,0,1,0|0,0,1]=3