0  B17R1.4995  CC(SC(=O)C1=CC=CS1)C(=O)NCC(=O)O MCULE-2343808590 [0,0,0,0,0,0|0,0,0]=0
1  B16R1.1297  O=C(O)CCC(=O)CCC(=O)C1=CC=CS1 MCULE-7603671224 [1,0,0,0,0,0|2,0,0]=3
2  B16R1.1297  O=C(O)CCC(=O)NNC(=O)C1=CC=CS1 MCULE-6692040705 [1,0,0,0,0,0|3,0,0]=4
3  B16R1.1297  O=C(O)CNC(=O)CNC(=O)C1=CC=CO1 MCULE-5613647801 [1,0,0,0,0,0|1,1,0]=3
4  B16R1.1297  O=C(O)CNC(=O)CNC(=O)C1=CC=CS1 MCULE-3298893559 [1,0,0,0,0,0|1,0,0]=2
5  B18R1.5064  C[C@@H](NC(=O)C1=CC=CC=C1)C(=O)SCC(=O)O MCULE-6877247967 [0,0,0,0,0,1|3,0,0]=4
6  B15R1.12292  O=C(O)CNC(=O)CSCC1=CC=CO1 MCULE-7032611156 [2,0,0,0,0,0|0,1,1]=4
7  B17R1.8223  CC1=CC=C(O1)C(=O)NCC(=O)NCC(=O)O MCULE-1188742370 [1,1,0,0,0,0|1,1,0]=4
8  B17R1.8223  CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)O MCULE-5335864698 [1,1,0,0,0,0|2,0,0]=4
9  B19R1.25987  CC(NC(=O)C(C)NC(=O)C1=CC=CC=C1)C(=O)O MCULE-8867033580 [0,1,0,0,0,1|2,0,0]=4
10  B19R1.278626  C[C@@H](NC(=O)C(C)(C)NC(=O)C1=CC=CS1)C(=O)N MCULE-5544902355 [0,2,0,0,0,0|2,0,0]=4
11  B17R1.1327  O=C(O)CNC(=O)CNC(=O)C1=CC=CC=C1 MCULE-8095253099 [1,0,0,0,0,1|2,0,0]=4