Alanyllysyllysine
6-amino-2-[[6-amino-2-(2-aminopropanoylamino)hexanoyl]amino]hexanoic acid
Molecular Identity
Alanyllysyllysine
6-amino-2-[[6-amino-2-(2-aminopropanoylamino)hexanoyl]amino]hexanoic acid
PubChem CID: 18411385
2D Structure
Properties
C15H31N5O4
Molecular Formula
345.44
Molecular Weight
g/mol
345.2376
Exact Mass
Da
-5.1
XLogP
Drug-like (Lipinski: < 5)
174
TPSA
May have limited oral absorption
6
H-Bond Donors
7
H-Bond Acceptors
405
Complexity
SMILES
Canonical SMILES
SMILES: CC(C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)O)NIsomeric SMILES
SMILES: CC(C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)O)NSynonyms(4)
alanyllysyllysineSCHEMBL11644217VCSABYLVNWQYQE-UHFFFAOYSA-NAKK
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Alanyllysyllysine
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