Submission Details
Molecule(s):
COc1ccccc1OCCNC(=O)c1cc[nH]c(=O)c1
COc1ccccc1OCCN(C)C(=O)c1cc(=O)[nH]c2ccccc12
CN(CCNC(=O)c1cc(=O)[nH]c2ccccc12)c1ccccc1
O=C(NCCNc1ccccc1)c1cc(=O)[nH]c2ccccc12
O=C(NCCOc1ccccc1)c1cc(=O)[nH]c2ccccc12
O=C(c1ccccc1)N1CCN(C(=O)c2cc(=O)[nH]c3ccccc23)CC1
O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(S(=O)(=O)c2ccccc2)CC1
Cc1cc(C)c(C)c(S(=O)(=O)N2CCN(C(=O)c3cc[nH]c(=O)c3)CC2)c1C
O=C(c1cc(=O)[nH]c2ccccc12)N1CCn2ccnc2C1
O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(Cc2ccccc2)CC1
COc1ccc(N2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)CC2)cc1
COc1cccc(N2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)CC2)c1
COc1ccccc1N1CCN(C(=O)c2cc(=O)[nH]c3ccccc23)CC1
O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccc(F)cc2)CC1
O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2cccc(F)c2)CC1
O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccccc2F)CC1
Design Rationale:
Scanning SAR around the 4-amidoquinolones identified from initial screen MAT-POS-916a2c5a-2 ; MAT-POS-916a2c5a-3 ; MAT-POS-916a2c5a-4 (note -: no structural / fragment data for these hits - componuds come from previous SARS-CoV screen)
Other Notes:
Will be proposed for synthesis by DNDi Open Synthesis Network (OSN)