O=C(O)Cc1ccc(O)c(NC(=O)c2conc2CCl)c1
CC(=O)c1cc(Cl)sc1NC(=O)c1conc1CCl
COC(=O)C(CBr)CNC(=O)c1conc1CCl
O=C(NCC(O)CBr)c1conc1CCl
COc1ccc(O)c(NC(=O)c2conc2CCl)c1
O=C(NCC(O)CCl)c1conc1CCl
COc1ccc(NC(=O)c2conc2CCl)c(C(=O)O)c1
COC(=O)C(C)CNC(=O)c1conc1CCl
COc1ccc(OC)c(NC(=O)c2conc2CCl)c1
COC(=O)C(Cl)CNC(=O)c1conc1CCl
O=C(NCC(CBr)C(=O)O)c1conc1CCl
O=C(O)CC(NC(=O)c1conc1CCl)C(=O)O
CCOC(=O)C(Br)CNC(=O)c1conc1CCl
CCOC(=O)CNC(=O)CNC(=O)c1conc1CCl
O=C(NCC(O)CF)c1conc1CCl
O=C(NCC(Br)C(=O)O)c1conc1CCl
O=C(CBr)C(=O)CNC(=O)c1conc1CCl
CCOC(=O)CCNC(=O)c1conc1CCl
O=C(NCCCOC1CCCCO1)c1conc1CCl
NC(CNC(=O)c1conc1CCl)C(=O)O
O=C(Nc1cc(F)c(F)cc1O)c1conc1CCl
COC(=O)CC(CNC(=O)c1conc1CCl)OC
O=C(NCC(O)CO)c1conc1CCl
C=C(CNC(=O)c1conc1CCl)C(=O)O
O=C(Nc1cc(F)cc(F)c1O)c1conc1CCl
O=C(O)c1cc(F)ccc1NC(=O)c1conc1CCl
CC(NC(=O)c1conc1CCl)C(=O)O
CCOC(=O)CC(=O)NC(=O)c1conc1CCl
O=C(CCNC(=O)c1conc1CCl)c1ccccc1
CC(CO)NC(=O)c1conc1CCl
O=C(Nc1cc(F)cc(Cl)c1O)c1conc1CCl
CC(C)(CNC(=O)c1conc1CCl)C(=O)O
COC(=O)C(NC(=O)c1conc1CCl)C(=O)OC
CC(NC(=O)c1conc1CCl)C(N)=O
Nc1ccc(NC(=O)c2conc2CCl)c(C(=O)O)c1
O=C(O)C(=O)CNC(=O)c1conc1CCl
CCC(=O)CCNC(=O)c1conc1CCl
O=C(Nc1cc(F)cc(Br)c1O)c1conc1CCl
O=C(Nc1cc(F)ccc1O)c1conc1CCl
CCC(=O)CNC(=O)c1conc1CCl
CCOC(CCNC(=O)c1conc1CCl)OCC
Cc1ccc(NC(=O)c2conc2CCl)c(C(=O)O)c1
CC(=O)C(C)NC(=O)c1conc1CCl
COC(=O)CCNC(=O)c1conc1CCl
COc1ccc(NC(=O)c2conc2CCl)c(OC)c1
N#Cc1ccccc1CNC(=O)c1conc1CCl
O=C(Nc1ccc(Cl)cc1O)c1conc1CCl
O=C(NCC1CCCCO1)c1conc1CCl
COC(=O)CC(=O)NC(=O)c1conc1CCl
O=C(Nc1cccc(F)c1C(=O)O)c1conc1CCl
CC(O)CNC(=O)c1conc1CCl
CCOC(=O)CC(=O)CNC(=O)c1conc1CCl
CSc1ccc(NC(=O)c2conc2CCl)c(C(=O)O)c1
O=C(Nc1cc(O)ccc1O)c1conc1CCl
O=C(Nc1ncccc1O)c1conc1CCl
O=C1NCC(CNC(=O)c2conc2CCl)O1
Nc1cccc(NC(=O)c2conc2CCl)c1C(=O)O
COCCOCCNC(=O)c1conc1CCl
CC(C)(NC(=O)c1conc1CCl)C(=O)O
COC(CCNC(=O)c1conc1CCl)OC
C=CCOC(=O)C(C)(C)NC(=O)c1conc1CCl
CC(=O)OCCNC(=O)c1conc1CCl
CCOC(=O)C(NC(=O)c1conc1CCl)C(C)=O
COC(=O)CC(=O)CNC(=O)c1conc1CCl
N=Nc1ccccc1NC(=O)c1conc1CCl
CCOC(CNC(=O)c1conc1CCl)OCC
CCC(NC(=O)c1conc1CCl)C(=O)OC
O=C(NCCCO)c1conc1CCl
O=C(CCl)CNC(=O)c1conc1CCl
O=C(CCCNC(=O)c1conc1CCl)c1ccc(O)cc1
CC(=O)C(NC(=O)c1conc1CCl)C(=O)N(C)C
O=C(O)CCNC(=O)c1conc1CCl
C=CCOC(=O)CNC(=O)c1conc1CCl
Nc1cc(Cl)c(O)c(NC(=O)c2conc2CCl)c1
O=C(Nc1cccc(C(=O)O)c1O)c1conc1CCl
NC(=O)CCNC(=O)c1conc1CCl
N=C(N)SCc1ccc(NC(=O)c2conc2CCl)cc1
O=C(NCS(=O)(=O)c1ccccc1)c1conc1CCl
O=C(O)c1cc(Cl)ccc1NC(=O)c1conc1CCl
COC(=O)C(NC(=O)c1conc1CCl)C(C)=O
COC(=O)c1cc(Cl)ccc1NC(=O)c1conc1CCl
O=C(Nc1ncccc1C(=O)O)c1conc1CCl
CC(=O)C(NC(=O)c1conc1CCl)C(C)=O
Nc1ccc(O)c(NC(=O)c2conc2CCl)c1
O=C(O)CNC(=O)c1conc1CCl
Nc1cc(Br)c(O)c(NC(=O)c2conc2CCl)c1
COc1cccc(NC(=O)c2conc2CCl)c1O
O=C(NCC1OCCO1)c1conc1CCl
CCOC(=O)C(C)(C)NC(=O)c1conc1CCl
O=C(Nc1ccc(F)cc1O)c1conc1CCl
CCC(NC(=O)c1conc1CCl)C(=O)O
O=C(NCCS(=O)(=O)O)c1conc1CCl
CC(=O)c1cc(Cl)ccc1NC(=O)c1conc1CCl
O=C(NCCC(O)CBr)c1conc1CCl
Cc1ccc(NC(=O)c2conc2CCl)c(O)c1
CCOC(=O)C(CC)NC(=O)c1conc1CCl
CCCOC(=O)CNC(=O)c1conc1CCl
O=C(Nc1cccc2cccnc12)c1conc1CCl
COC(CNC(=O)c1conc1CCl)OC
O=C(NCC1CCCO1)c1conc1CCl
Chloroacetamides are well known inhibitors of cysteine proteases. This is set 3 of 6 novel ChloroMethyl- Heteroaromatics with commercially available R-group substituents which are predicted to bind to 6WNP using the THINK software (https://treweren.com). No detailed reactivity calculations have been completed at this time but it is expected that some of these series will show greater reactivity and more reversibility than chloroacetamides.
SD files of the docked molecules are available. More series have been docked.