Submission Details
Molecule(s):
Cc1ccc(OCC(=O)NCC2NCCc3ccc(S(N)(=O)=O)cc32)cc1
Cc1ccc(OCC(=O)CCN2CCCc3ccc(S(N)(=O)=O)cc32)cc1
NS(=O)(=O)c1ccc2c(c1)N(C(=O)N1CCC(O)CC1)CCC2
Cc1nnc(CN2CCCc3ccc(S(N)(=O)=O)cc32)s1
NS(=O)(=O)c1ccc2c(c1)N(CCC(=O)c1c[nH]c3ncccc13)CCC2
Cc1nnc(Cc2nccc3ccc(S(N)(=O)=O)cc23)s1
Design Rationale:
Compounds designed by eye, attempting to combine x0195 with other non-covalent fragments. Some scaffolds of fragments were changed to ensure the appropriate geometry for combining the fragments.