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View Conjugates details

ConjuPepDB ID: cpd01420

Chemical structure


molecule
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cpd01420


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
FYPWMKG 1H-Imidazole-2-carboxamide, N-[1-(3-aminopropyl)-5-[[[5-[[[4-[[2-[[[5-[[[5-[[[5-[[[3-[[3-(dimethylamino)propyl]amino]-3-oxopropyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-imidazol-4-yl]amino]-4-oxobutyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1H-pyrrol-3-yl]-1-methyl-4-[[(1-methyl-1H-imidazol-2-yl)carbonyl]amino]-
Identification
ConjuPepDB ID

cpd01420

Smiles
Molecular weight

2217.04

Molecular formula

C108H136N32O19S

Chemical name
Peptide information
Sequence (one letter)

FYPWMKG

Length

7

Peptide name

N/A

External ID
CAS number

619329-60-1

Other information
Application

Synthesis

Additional function

DNA binding

Pharmacological class

other

Conjugate type

amide

Linker

no

Small molecule

1H-Imidazole-2-carboxamide, N-[1-(3-aminopropyl)-5-[[[5-[[[4-[[2-[[[5-[[[5-[[[5-[[[3-[[3-(dimethylamino)propyl]amino]-3-oxopropyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-imidazol-4-yl]amino]-4-oxobutyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1H-pyrrol-3-yl]-1-methyl-4-[[(1-methyl-1H-imidazol-2-yl)carbonyl]amino]-

Small molecule CAS

933050-96-5

Structure method

X-ray crystallography

Calculated properties
LogP

-0.54075

Rotatable bonds

56

H bond donor

20

H bond acceptor

24

Polar surface area (PSA)

658.40000

Citations
ID Title Year Authors Journal DOI

cpdart0219

Toward Artificial Developmental Regulators

2003

Arndt, Hans-Dieter; Hauschild, Karl E.; Sullivan, David P.; Lake, Kara; Dervan, Peter B.; Ansari, Aseem Z.

Journal of the American Chemical Society

..