mefloquine

Ligand id: 4252

Name: mefloquine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 45.15
Molecular weight 378.12
XLogP 5.17
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1989))
IUPAC Name
(S)-[2,8-bis(trifluoromethyl)quinolin-4-yl](2R)-piperidin-2-ylmethanol
International Nonproprietary Names
INN number INN
3777 mefloquine
Synonyms
Lariam®
Database Links
CAS Registry No. 53230-10-7 (source: Scifinder)
ChEMBL Ligand CHEMBL172
DrugBank Ligand DB00358
PubChem CID 40692
Search Google for chemical match using the InChIKey XEEQGYMUWCZPDN-DOMZBBRYSA-N
Search Google for chemicals with the same backbone XEEQGYMUWCZPDN
Search PubMed clinical trials mefloquine
Search PubMed titles mefloquine
Search PubMed titles/abstracts mefloquine
Search UniChem for chemical match using the InChIKey XEEQGYMUWCZPDN-DOMZBBRYSA-N
Search UniChem for chemicals with the same backbone XEEQGYMUWCZPDN
Wikipedia Mefloquine
Comments
The approved drug mefloquine is a racemic mixture of (R,S)- and (S,R)-enantiomers. Note that the ChEMBL link is to the non-stereoisomeric form of the molecule. PubChem lists 9 stereoisotopes.