dibucaine

Ligand id: 7159

Name: dibucaine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 57.95
Molecular weight 343.23
XLogP 4.58
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
2-butoxy-N-[2-(diethylamino)ethyl]quinoline-4-carboximidic acid
International Nonproprietary Names
INN number INN
108 cinchocaine
Synonyms
Cincain ® | cincaine chloride | Nupercaine ®
Database Links
CAS Registry No. 85-79-0
ChEMBL Ligand CHEMBL1086
DrugBank Ligand DB00527
GtoPdb PubChem SID 178103734
PubChem CID 3025
Search Google for chemical match using the InChIKey PUFQVTATUTYEAL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PUFQVTATUTYEAL
Search PubMed clinical trials cinchocaine
Search PubMed titles cinchocaine
Search PubMed titles/abstracts cinchocaine
Search UniChem for chemical match using the InChIKey PUFQVTATUTYEAL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PUFQVTATUTYEAL
Wikipedia Dibucaine
Comments
Marketed formulations may contain dibucaine hydrochloride (PubChem CID 521951).