ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

Compound Report Card

Compound Name and Classification

Compound ID CHEMBL535650
CHEMBL535650
Compound Name MEFLOQUINE HYDROCHLORIDE
ChEMBL Synonyms Lariam | Fansimef | Ro-215998001 | Mefloquine HCl
Max Phase 4 (Approved)
Trade Names Fansimef | Lariam | Mefloquine HCl
Molecular Formula C17H17ClF6N2O

Additional synonyms for CHEMBL535650 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cl.OC(C1CCCCN1)c2cc(nc3c(cccc23)C(F)(F)F)C(F)(F)F
Standard InChI InChI=1S/C17H16F6N2O.ClH/c18-16(19,20)11-5-3-4-9-10(15(26)12 ...
Download InChI
Standard InChI Key WESWYMRNZNDGBX-UHFFFAOYSA-N

Mechanism of Action

Mechanism of Action ChEMBL Target References
Ferriprotoporphyrin IX inhibitor Ferriprotoporphyrin IX PubMed

Molecule Features

CHEMBL535650 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Racemic Mixture Prodrug:N Oral:Y Parenteral:N Topical:N Black Box:Y Availability Type:Prescription-only

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 1 structural alerts for CHEMBL535650. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL535650

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
378.3 378.1167 4.3 4 45.15 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 2 0 3 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
12.81 9.24 2.2 .5 2 26 0.78

Compound Cross References

ChemSpider ChemSpider:WESWYMRNZNDGBX-UHFFFAOYSA-N
DailyMed mefloquine hydrochloride
PubChem SID: 56463353

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL535650



ACToR 51773-92-3
eMolecules 33507316
PubChem 44326656 441362 57516060
PubChem: Thomson Pharma 14806643
SureChEMBL SCHEMBL41095

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/WESWYMRNZNDGBX-UHFFFAOYSA-N spacer
spacer