General
Preferred name
N-tert-butylisoquine
Synonyms
GSK369796 ()
GSK369796 Dihydrochloride ()
GSK369796, N-tert-butylisoquine ()
GSK-369796 ()
ZINC1912685 ()
BDBM50134936 ()
CHEMBL147806 ()
N-tert-butyl isoquine ()
Ntbisq ()
GSK 369796 ()
GSK369796 (hydrochloride) ()
P&D ID
PD102157
CAS
1010411-21-8
Tags
available
drug candidate
Drug Status
investigational
Max Phase
1.0
Drug indication
Malaria
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
GSK369796 Dihydrochloride is an affordable and effective antimalarial and inhibits hERG potassium ion channel repolarization with an IC50 of 7.5 ¦ÌM.
PRICE
189
DESCRIPTION
GSK369796 Dihydrochloride (N-tert-butylisoquine),is an anti-malaria drug candidate. is an affordable and effective antimalarial and inhibits hERG potassium ion channel repolarization(IC50 of 7.5 ??M)
DESCRIPTION
GSK369796 is a 4-aminoquinoline antimalarial compound that was synthesised using as the template molecule .
The Malaria tab on this ligand page provides additional curator comments of relevance to the Guide to MALARIA PHARMACOLOGY. (GtoPdb)
The Malaria tab on this ligand page provides additional curator comments of relevance to the Guide to MALARIA PHARMACOLOGY. (GtoPdb)
DESCRIPTION
GSK369796 Dihydrochloride (N-tert-butylisoquine),is an anti-malaria drug candidate. is an affordable and effective antimalarial and inhibits hERG potassium ion channel repolarization(IC50 of 7.5 μM)
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
0
Organisms
3
Compound Sets
9
AdooQ Bioactive Compound Library
Cayman Chemical Bioactives
ChEMBL Drugs
Drug Repurposing Hub
Guide to Pharmacology
MedChem Express Bioactive Compound Library
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
16
Molecular Weight
355.15
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
3
Rotatable Bonds
4
Ring Count
3
Aromatic Ring Count
3
cLogP
5.23
TPSA
57.18
Fraction CSP3
0.25
Chiral centers
0.0
Largest ring
6.0
QED
0.6
QED
0.6
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Parasite
Potassium Channel
potassium ion channel
MOA
Potassium Channel antagonist
Pathway
Membrane Transporter/Ion Channel
Microbiology/virology
Anti-infection
Source data
