Submission Details
Molecule(s):
COc1cc(Cl)cc(OC(=O)Nc2cccnc2)c1
O=C(Nc1cccnc1)Oc1cc(O)cc(Cl)c1
O=S(=O)(Cc1cc(O)cc(Cl)c1)Nc1cccnc1
COc1cc(Cl)cc(CS(=O)(=O)Nc2cccnc2)c1
CC(C)c1cc(Cl)cc(S(=O)(=O)/C=C/c2cccnc2)c1
O=S(=O)(/C=C/c1cccnc1)c1cccc(-c2c(F)cccc2F)c1
O=S(=O)(/C=C/c1cccnc1)c1cccc(-c2ccc(F)cc2F)c1
O=S(=O)(/C=C/c1cccnc1)c1cccc(-c2ccccc2F)c1
N#CCc1cccc(S(=O)(=O)/C=C/c2cccnc2)c1
O=S(=O)(/C=C/c1cccnc1)c1cccc(-c2ncccn2)c1
COc1ccc(S(=O)(=O)/C=C/c2cccnc2)cc1-c1ncccn1
Design Rationale:
Molecular docking and structure-guided design of synthetically feasible fragments.