Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UKNOWN
UNII: UP8J9CA76I

Structure

InChI Key QGBWIYLNOBYNDL-UHFFFAOYSA-N
Smile O=C(O)C1(Sc2ccnc3ccc(Br)cc23)CCC1
InChI
InChI=1S/C14H12BrNO2S/c15-9-2-3-11-10(8-9)12(4-7-16-11)19-14(13(17)18)5-1-6-14/h2-4,7-8H,1,5-6H2,(H,17,18)

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H12BrNO2S
Molecular Weight 338.23
AlogP 4.1
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 50.19
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 19.0

Pharmacology

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Gout 3 D006073 ClinicalTrials
Hyperuricemia 2 D033461 ClinicalTrials
Liver Diseases 1 D008107 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL3746329
FDA SRS UP8J9CA76I
SureChEMBL SCHEMBL16247926
ZINC ZINC000220384946