SULFATHIAZOLE

/static/temp/default.svg Search structure
Synonyms
Status
Molecule Category Free-form
ATC D06BA02 J01EB07
UNII Y7FKS2XWQH
EPA CompTox DTXSID8026068

Structure

InChI Key JNMRHUJNCSQMMB-UHFFFAOYSA-N
Smiles 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

Mechanism of Action Action Reference
Bacterial dihydropteroate synthase inhibitor INHIBITOR PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 85.21-89.12
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 85.21-89.12

Cross References

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