General Information of This Payload
Payload ID
PAY0COVTH
Name
Imiquimod
Synonyms
imiquimod
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Target Toll-like receptor 7 (TLR7); Toll-like receptor 8 (TLR8)
Formula
C22H25N5
Isosmiles
NCC1=CC=C(CN(C(CCCC)=N2)C3=C2C(N)=NC4=CC=CC=C43)C=C1
PubChem CID
52945312
InChI
InChI=1S/C22H25N5/c1-2-3-8-19-26-20-21(17-6-4-5-7-18(17)25-22(20)24)27(19)14-16-11-9-15(13-23)10-12-16/h4-7,9-12H,2-3,8,13-14,23H2,1H3,(H2,24,25)
InChIKey
SDSKFWHQCNBICO-UHFFFAOYSA-N
Pharmaceutical Properties
Molecule Weight
359.477
Polar area
82.75
Complexity
1060.790051
xlogp Value
4.0163
Heavy Count
27
Rot Bonds
6
Hbond acc
5
Hbond Donor
2
The activity data of This Payload
Standard Type Value Units Cell line Disease Model Cell line ID Reference
Half Maximal Effective Concentration (EC50) 0.00402 ug.mL-1
HEK293 cells
Normal
CVCL_0045 
Half Maximal Effective Concentration (EC50) 0.0675 ug.mL-1
HEK293 cells
Normal
CVCL_0045 
Half Maximal Effective Concentration (EC50) 1 nM Undisclosed Undisclosed Undisclosed
Half Maximal Effective Concentration (EC50) 1 nM Undisclosed Undisclosed Undisclosed
Half Maximal Effective Concentration (EC50) 130 nM
Cancer cells
Multiple myeloma, Plasma cell myeloma
Undisclosed
Half Maximal Effective Concentration (EC50) 20 nM
HEK cells
Endocervical adenocarcinoma
CVCL_M624 
Half Maximal Effective Concentration (EC50) 20 nM Undisclosed Undisclosed Undisclosed
Half Maximal Effective Concentration (EC50) 217 nM Undisclosed Undisclosed Undisclosed
Half Maximal Effective Concentration (EC50) 217 nM Undisclosed Undisclosed Undisclosed
Half Maximal Effective Concentration (EC50) 528 nM
HEK293 cells
Normal
CVCL_0045 
Half Maximal Effective Concentration (EC50) 55 nM
HEK293 cells
Normal
CVCL_0045 
Half Maximal Effective Concentration (EC50) 8 nM
Cancer cells
Multiple myeloma, Plasma cell myeloma
Undisclosed
Half Maximal Effective Concentration (EC50) 800 nM
HEK cells
Endocervical adenocarcinoma
CVCL_M624 
Half Maximal Inhibitory Concentration (IC50) 24.5 uM
Human HEK 293 cells
Normal
CVCL_0045 
[1]
Half Maximal Inhibitory Concentration (IC50) 24.5 uM
Human HEK 293 cells
Normal
CVCL_0045 
[1]
Half Maximal Inhibitory Concentration (IC50) 6.7 uM
HEK 293 cells
Normal
CVCL_0063 
[1]
Half Maximal Inhibitory Concentration (IC50) 6.7 uM
HEK 293 cells
Normal
CVCL_0063 
[1]
Each Antibody-drug Conjugate Related to This Payload
References
Ref 1 A bispecific antibody-drug conjugate targeting pCAD and CDH17 has antitumor activity and improved tumor-specificity