Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: R05CB15
UNII: 76J0853EKA

Structure

InChI Key QGFORSXNKQLDNO-UHFFFAOYSA-N
Smile O=C(O)CSCC(=O)NC1CCSC1=O
InChI
InChI=1S/C8H11NO4S2/c10-6(3-14-4-7(11)12)9-5-1-2-15-8(5)13/h5H,1-4H2,(H,9,10)(H,11,12)

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H11NO4S2
Molecular Weight 249.31
AlogP -0.05
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 83.47
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 15.0

Pharmacology

Action Mechanism of Action Reference
None Anti-inflammatory, anti-oxidant PubMed HMA PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Pulmonary Disease, Chronic Obstructive 3 D029424 ClinicalTrials
Bronchitis, Chronic 2 D029481 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 84611-23-4
ChEBI 135014
ChEMBL CHEMBL1697744
DrugBank DB05057
DrugCentral 1041
EPA CompTox DTXSID8048735
FDA SRS 76J0853EKA
PubChem 65632
SureChEMBL SCHEMBL21721