Submission Details
Molecule(s):
N#Cc1ccccc1C1CC(c2cccc(Cl)c2)C(=O)N(c2cncc3ccccc23)C1
N#Cc1ccccc1C1CN(c2cncc3ccccc23)C(=O)CC1c1cc(Cl)cc(OCCC(F)(F)F)c1
CCCOc1cc(Cl)cc(C2CC(=O)N(c3cncc4ccccc34)CC2c2ccccc2C#N)c1
O=C1CC(c2cc(Cl)cc(OCCC(F)(F)F)c2)C(c2c[nH]c(=O)[nH]c2=O)CN1c1cncc2ccccc12
CCCOc1cc(Cl)cc(C2CC(=O)N(c3cncc4ccccc34)CC2c2c[nH]c(=O)[nH]c2=O)c1
O=C1CC(c2cccc(Cl)c2)C(c2c[nH]c(=O)[nH]c2=O)CN1c1cncc2ccccc12
Design Rationale:
Merges of PET-UNK-c9c1e0d8-3 with nanomolar inhibitors from Zhang et al. https://pubs.acs.org/doi/10.1021/acscentsci.1c00039