SULFAMETHOXYPYRIDAZINE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
ATC: J01ED05
UNII: T034E4NS2Z

Structure
InChI Key VLYWMPOKSSWJAL-UHFFFAOYSA-N
Smile COc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1
InChI
InChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H12N4O3S
Molecular Weight 280.31
AlogP 0.87
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 107.2
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 19.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Bacterial dihydropteroate synthase inhibitor PubMed PubMed 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
- - - - 141

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 102516
ChEMBL CHEMBL268869
DrugBank DB13773
DrugCentral 2515
EPA CompTox DTXSID5023611
FDA SRS T034E4NS2Z
PubChem 5330
SureChEMBL SCHEMBL93617
ZINC ZINC000000049141
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