General Information of This Linker
Linker ID
LIN00024
Linker Name
3-(1H-1,2,3-Triazol-4-yl)propanoic acid
Linker Type
Enzyme-sensitive linkers
Structure
Formula
C5H7N3O2
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 141.13
Lipid-water partition coefficient (xlogp) -0.6
Hydrogen Bond Donor Count (hbonddonor) 2
Hydrogen Bond Acceptor Count (hbondacc) 4
Rotatable Bond Count (rotbonds) 3
PubChem CID
53981275
Canonical smiles
C1=NNN=C1CCC(=O)O
InChI
InChI=1S/C5H7N3O2/c9-5(10)2-1-4-3-6-8-7-4/h3H,1-2H2,(H,9,10)(H,6,7,8)
InChIKey
JYKLORHRQMBGDN-UHFFFAOYSA-N
IUPAC Name
3-(2H-triazol-4-yl)propanoic acid
Each Peptide-drug Conjugate Related to This Linker
Full Information of The Activity Data of The PDC(s) Related to This Linker
EETI-2.5Z-ester-gemcitabine [Investigative]
Revealed Based on the Cell Line Data
Click To Hide/Show 2 Activity Data Related to This Level
Experiment 1 Reporting the Activity Data of This PDC [1]
Indication Glioblastoma
Efficacy Data Half Maximal Inhibitory Concentration (IC50)
5.2 ± 3.6 nM
Evaluation Method CCK-8 assay
Description
Cell proliferation was quantified 4 d after treatment with each compoundusing CCK-8 colorimetric assays and compared to the untreated control.
In Vitro Model Glioblastoma U-87MG cell CVCL_0022
Experiment 2 Reporting the Activity Data of This PDC [1]
Indication Glioblastoma
Efficacy Data Half Maximal Effective Concentration (EC50)
8.5 ± 3.3 nM
Evaluation Method CCK-8 assay
Description
Cell proliferation was quantified 4 d after treatment with each compoundusing CCK-8 colorimetric assays and compared to the untreated control.
In Vitro Model Glioblastoma U-87MG cell CVCL_0022
References
Ref 1 Integrin-Targeting Knottin Peptide-Drug Conjugates Are Potent Inhibitors of Tumor Cell Proliferation. Angew Chem Int Ed Engl. 2016 Aug 16;55(34):9894-7. doi: 10.1002/anie.201603488. Epub 2016 Jun 15.