flavoxate

Ligand id: 7187

Name: flavoxate

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 55.84
Molecular weight 391.18
XLogP 5.67
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1970))
IUPAC Name
2-(piperidin-1-yl)ethyl 3-methyl-4-oxo-2-phenyl-4H-chromene-8-carboxylate
International Nonproprietary Names
INN number INN
1929 flavoxate
Synonyms
Urispas® | W-61
Database Links
CAS Registry No. 15301-69-6
ChEMBL Ligand CHEMBL1493
DrugBank Ligand DB01148
PubChem CID 3354
Search Google for chemical match using the InChIKey SPIUTQOUKAMGCX-UHFFFAOYSA-N
Search Google for chemicals with the same backbone SPIUTQOUKAMGCX
Search PubMed clinical trials flavoxate
Search PubMed titles flavoxate
Search PubMed titles/abstracts flavoxate
Search UniChem for chemical match using the InChIKey SPIUTQOUKAMGCX-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone SPIUTQOUKAMGCX
Wikipedia Flavoxate
Comments
Marketed formulations may contain flavoxate hydrochloride (PubChem CID 441345).