Phenylalanyl-Lysine

Details

• Internal ID: 3e6616fa-47b5-43f7-bad3-f0e22beade33
• Taxonomy: Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Dipeptides
• IUPAC Name: 6-amino-2-[(2-amino-3-phenylpropanoyl)amino]hexanoic acid
• SMILES (Canonical): C1=CC=C(C=C1)CC(C(=O)NC(CCCCN)C(=O)O)N
• SMILES (Isomeric): C1=CC=C(C=C1)CC(C(=O)NC(CCCCN)C(=O)O)N
• InChI: InChI=1S/C15H23N3O3/c16-9-5-4-8-13(15(20)21)18-14(19)12(17)10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,16-17H2,(H,18,19)(H,20,21)
• InChI Key: FADYJNXDPBKVCA-UHFFFAOYSA-N
• Popularity: 0 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₅H₂₃N₃O₃
• Molecular Weight: 293.36 g/mol
• Exact Mass: 293.17394160 g/mol
• Topological Polar Surface Area (TPSA): 118.00 Ų
• XlogP: -2.70

Synonyms

• Phenylalanyl-Lysine
• SCHEMBL1711485
• CHEBI:174099
• FADYJNXDPBKVCA-UHFFFAOYSA-N
• FK
• 6-amino-2-[(2-amino-3-phenylpropanoyl)amino]hexanoic acid

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL2581	P07339	Cathepsin D	98.25%	98.95%
CHEMBL1255126	O15151	Protein Mdm4	97.02%	90.20%
CHEMBL221	P23219	Cyclooxygenase-1	96.86%	90.17%
CHEMBL4657	Q6V1X1	Dipeptidyl peptidase VIII	95.10%	97.21%
CHEMBL3060	Q9Y345	Glycine transporter 2	94.24%	99.17%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	94.10%	96.09%
CHEMBL1795139	Q8IU80	Transmembrane protease serine 6	93.48%	98.33%
CHEMBL3091268	Q92753	Nuclear receptor ROR-beta	91.75%	95.50%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	91.67%	91.11%
CHEMBL3359	P21462	Formyl peptide receptor 1	89.97%	93.56%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	88.97%	95.56%
CHEMBL2514	O95665	Neurotensin receptor 2	88.12%	100.00%
CHEMBL2327	P21452	Neurokinin 2 receptor	86.98%	98.89%
CHEMBL2035	P08912	Muscarinic acetylcholine receptor M5	86.75%	94.62%
CHEMBL1907591	P30926	Neuronal acetylcholine receptor; alpha4/beta4	85.59%	100.00%
CHEMBL3976	Q9UHL4	Dipeptidyl peptidase II	84.93%	92.29%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	83.32%	94.45%
CHEMBL4227	P25090	Lipoxin A4 receptor	83.01%	100.00%
CHEMBL4793	Q86TI2	Dipeptidyl peptidase IX	82.17%	96.95%
CHEMBL4101	P17612	cAMP-dependent protein kinase alpha-catalytic subunit	81.45%	82.86%
CHEMBL3891	P07384	Calpain 1	81.40%	93.04%
CHEMBL1808	P12821	Angiotensin-converting enzyme	80.65%	93.39%
CHEMBL3807	P17706	T-cell protein-tyrosine phosphatase	80.59%	93.00%

Plants that contains it

• Phytolacca americana

Cross-Links

• PubChem: 15607819
• LOTUS: LTS0191779
• wikiData: Q104992193