SULFATHIAZOLE

Search structure
Synonyms:
Status: Approved (1945)
Entry Type: Small molecule
Molecule Category: Parent
ATC: D06BA02
UNII: Y7FKS2XWQH

Structure
InChI Key JNMRHUJNCSQMMB-UHFFFAOYSA-N
Smile Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
InChI
InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H9N3O2S2
Molecular Weight 255.32
AlogP 1.53
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 85.08
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 16.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial dihydropteroate synthase inhibitor PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Transferase
- 2500 - - -
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Endothelin receptor
- 69000 - - -
Transcription factor
- 9000 - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 85

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 9337
ChEMBL CHEMBL437
DrugBank DB06147
DrugCentral 2527
EPA CompTox DTXSID8026068
FDA SRS Y7FKS2XWQH
Human Metabolome Database HMDB0015619
KEGG C11169
PDB YTZ
PubChem 5340
SureChEMBL SCHEMBL94165
ZINC ZINC000000121458
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