SULFAMETER

Search structure
Trade Names:
Synonyms:
Status: Approved (1966) Withdrawn (1988)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 3L179F09D6

Structure
InChI Key GPTONYMQFTZPKC-UHFFFAOYSA-N
Smile COc1cnc(NS(=O)(=O)c2ccc(N)cc2)nc1
InChI
InChI=1S/C11H12N4O3S/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)

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 ISBN 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
- - - - 113

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 651-06-9
ChEBI 53727
ChEMBL CHEMBL1200359
DrugBank DB06821
DrugCentral 2511
EPA CompTox DTXSID5023613
FDA SRS 3L179F09D6
PubChem 5326
SureChEMBL SCHEMBL79417
ZINC ZINC000000049142
CONTENTS