SULFISOXAZOLE ACETYL

Search structure
Trade Names:
Synonyms:
Status: Approved (1953)
Entry Type: Small molecule
Molecule Category: Parent Prodrug
UNII: WBT5QH3KED

Structure
InChI Key JFNWFXVFBDDWCX-UHFFFAOYSA-N
Smile CC(=O)N(c1onc(C)c1C)S(=O)(=O)c1ccc(N)cc1
InChI
InChI=1S/C13H15N3O4S/c1-8-9(2)15-20-13(8)16(10(3)17)21(18,19)12-6-4-11(14)5-7-12/h4-7H,14H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H15N3O4S
Molecular Weight 309.35
AlogP 1.62
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 106.5
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial dihydropteroate synthase inhibitor
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Transferase
- - - -
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - 8.59-10.4
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Endothelin receptor
- 13000 - - -

Related Entries

Scaffolds

Mixture
Mixture

Cross References

Resources Reference
CAS NUMBER 80-74-0
ChEBI 135975
ChEMBL CHEMBL1200910
DrugBank DB14033
DrugCentral 4458
EPA CompTox DTXSID4023620
FDA SRS WBT5QH3KED
PubChem 6662
SureChEMBL SCHEMBL41727
ZINC ZINC000000002114
CONTENTS