Leptothiazinone B

Details

• Internal ID: 44bc92c5-a131-4f0c-8ceb-552fa2fc897d
• Taxonomy: Organoheterocyclic compounds > Benzothiazines
• IUPAC Name: 5-hydroxy-7-(2-hydroxyethyl)-3,4-dihydro-1,4-benzothiazin-2-one
• InChI: InChI=1S/C10H11NO3S/c12-2-1-6-3-7(13)10-8(4-6)15-9(14)5-11-10/h3-4,11-13H,1-2,5H2
• InChI Key: LQQUFKZMSYJJGW-UHFFFAOYSA-N
• Popularity: 2 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₀H₁₁NO₃S
• Molecular Weight: 225.27 g/mol
• Exact Mass: 225.04596439 g/mol
• Topological Polar Surface Area (TPSA): 94.90 Ų
• XlogP: 1.20

Synonyms

There are no found synonyms.

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	97.62%	91.11%
CHEMBL2581	P07339	Cathepsin D	93.32%	98.95%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	92.65%	96.09%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	92.39%	94.45%
CHEMBL4208	P20618	Proteasome component C5	85.05%	90.00%
CHEMBL4016	P42262	Glutamate receptor ionotropic, AMPA 2	84.30%	86.92%
CHEMBL5845	P23415	Glycine receptor subunit alpha-1	84.05%	90.71%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	82.67%	95.56%
CHEMBL1860	P10827	Thyroid hormone receptor alpha	80.59%	99.15%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 146683978
• LOTUS: LTS0204144
• wikiData: Q105155693