Structure

InChI Key VGZSUPCWNCWDAN-UHFFFAOYSA-N
Smile CC(=O)c1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1
InChI
InChI=1S/C15H20N2O4S/c1-11(18)12-7-9-14(10-8-12)22(20,21)17-15(19)16-13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3,(H2,16,17,19)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H20N2O4S
Molecular Weight 324.4
AlogP 2.21
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 92.34
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 22.0

Pharmacology

Action Mechanism of Action Reference
BLOCKER Sulfonylurea receptor 1, Kir6.2 blocker PubMed PubMed Wikipedia

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Cataract 3 D002386 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 968-81-0
ChEBI 28052
ChEMBL CHEMBL1589
DrugBank DB00414
DrugCentral 57
EPA CompTox DTXSID7020007
FDA SRS QGC8W08I6I
Human Metabolome Database HMDB0014558
Guide to Pharmacology 6793
KEGG C06806
PharmGKB PA164777011
PubChem 1989
SureChEMBL SCHEMBL37620
ZINC ZINC000018067894