General Information of This Peptide-drug Conjugate (PDC)
PDC ID
PDC_00078
PDC Name
Conjugates 8b
PDC Status
Investigative
Structure
Peptide Name
c(RGDfK)
 Peptide Info 
Receptor Name
Integrin alpha-V; Integrin beta-3 (ITGAV; ITGB3)
 Receptor Info 
Drug Name
Chlorambucil
 Drug Info 
Therapeutic Target
DNA topoisomerase 2-alpha (TOP2A)
 Target Info 
Linker Name
Ester bond
 Linker Info 
Peptide Modified Type
Amino acid modifications; Cyclization modification
Modified Segment
Use D-amino acids instead of L-amino acids; Head-to-tail cyclization
Formula
C38H51Cl2N9O9
#Ro5 Violations (Lipinski): 3 Molecular Weight 848.786
Lipid-water partition coefficient (xlogp) -0.11383
Hydrogen Bond Donor Count (hbonddonor) 9
Hydrogen Bond Acceptor Count (hbondacc) 10
Rotatable Bond Count (rotbonds) 19