Parazoanthine C

Details

• Internal ID: fe77e52b-db21-4f8a-b322-a5ac2ade9ccd
• Taxonomy: Organoheterocyclic compounds > Azolidines > Imidazolidines > Hydantoins
• IUPAC Name: 2-[(3Z)-3-[1-[(E)-2-(4-methoxyphenyl)ethenyl]-2,5-dioxoimidazolidin-4-ylidene]propyl]guanidine
• InChI: InChI=1S/C16H19N5O3/c1-24-12-6-4-11(5-7-12)8-10-21-14(22)13(20-16(21)23)3-2-9-19-15(17)18/h3-8,10H,2,9H2,1H3,(H,20,23)(H4,17,18,19)/b10-8+,13-3-
• InChI Key: OIBAUBRNXIHMBQ-RMLQCRNUSA-N
• Popularity: 2 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₆H₁₉N₅O₃
• Molecular Weight: 329.35 g/mol
• Exact Mass: 329.14878949 g/mol
• Topological Polar Surface Area (TPSA): 123.00 Ų
• XlogP: 0.30

Synonyms

• CHEMBL1078089

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
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	98.33%	91.11%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	96.64%	95.56%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	96.59%	96.09%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	96.47%	94.45%
CHEMBL1293249	Q13887	Kruppel-like factor 5	94.95%	86.33%
CHEMBL4208	P20618	Proteasome component C5	93.93%	90.00%
CHEMBL3192	Q9BY41	Histone deacetylase 8	91.73%	93.99%
CHEMBL3492	P49721	Proteasome Macropain subunit	85.94%	90.24%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	85.55%	96.00%
CHEMBL5608	Q16288	NT-3 growth factor receptor	84.98%	95.89%
CHEMBL3922	P50579	Methionine aminopeptidase 2	84.73%	97.28%
CHEMBL2535	P11166	Glucose transporter	84.58%	98.75%
CHEMBL3807	P17706	T-cell protein-tyrosine phosphatase	83.32%	93.00%
CHEMBL3137262	O60341	LSD1/CoREST complex	81.99%	97.09%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 44482322
• LOTUS: LTS0027105
• wikiData: Q105192416