Trade Names
Synonyms
Status
Molecule Category Salt-form
UNII RQ6LP6Z0WY
EPA CompTox DTXSID00156334

Structure

InChI Key UILOTUUZKGTYFQ-UHFFFAOYSA-N
Smiles CC(=O)O.NCc1ccc(S(N)(=O)=O)cc1
InChI
InChI=1S/C7H10N2O2S.C2H4O2/c8-5-6-1-3-7(4-2-6)12(9,10)11;1-2(3)4/h1-4H,5,8H2,(H2,9,10,11);1H3,(H,3,4)

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H14N2O4S
Molecular Weight 246.29
AlogP -0.21
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 86.18
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 12.0

Pharmacology

Mechanism of Action Action Reference
Bacterial dihydropteroate synthase inhibitor INHIBITOR FDA ISBN PubMed

Cross References

Resources Reference
ChEBI 31792
ChEMBL CHEMBL1201161
FDA SRS RQ6LP6Z0WY
KEGG C07106
PubChem 25590
SureChEMBL SCHEMBL41627
ZINC ZINC00001644