SULFISOXAZOLE

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Trade Names
Synonyms
Status
Molecule Category Free-form
UNII 740T4C525W
EPA CompTox DTXSID6021292

Structure

InChI Key NHUHCSRWZMLRLA-UHFFFAOYSA-N
Smiles Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C
InChI
InChI=1S/C11H13N3O3S/c1-7-8(2)13-17-11(7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6,14H,12H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H13N3O3S
Molecular Weight 267.31
AlogP 1.67
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 98.22
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 18.0

Pharmacology

Mechanism of Action Action Reference
Bacterial dihydropteroate synthase inhibitor INHIBITOR PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Endothelin receptor
- 780-850 - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 78.99-90.16
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 78.99-90.16
Oryctolagus cuniculus
- 780 - - -

Cross References

Resources Reference
ChEBI 102484
ChEMBL CHEMBL453
DrugBank DB00263
DrugCentral 2529
FDA SRS 740T4C525W
Human Metabolome Database HMDB0014408
KEGG C07318
PharmGKB PA164748964
PubChem 5344
SureChEMBL SCHEMBL23467
ZINC ZINC000096006009
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