General
Preferred name
MITOQUINONE MESYLATE
Synonyms
MitoQ10 mesylate ()
MitoQ mesylate ()
Mitoquinone (mesylate) ()
MitoQ (mesylate) ()
MitoQ10 (mesylate) ()
Mitoquinone (MitoQ10) mesylate ()
MitoQ, Mitoubiquinone ()
Mitoquinone methanesulfonate ()
Mitoq ()
P&D ID
PD063495
CAS
845959-50-4
Tags
available
drug candidate
Drug Status
investigational
Max Phase
Phase 2
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()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
Cayman Chemical Bioactives
ChEMBL Drugs
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
11
Properties
(calculated by RDKit )
Molecular Weight
678.28
Hydrogen Bond Acceptors
7
Hydrogen Bond Donors
0
Rotatable Bonds
16
Ring Count
4
Aromatic Ring Count
3
cLogP
6.63
TPSA
109.8
Fraction CSP3
0.37
Chiral centers
0.0
Largest ring
6.0
QED
0.07
Structural alerts
1
quinone_A(370)
[!#6&!#1]=[#6]-1-[#6]=,:[#6]-[#6](=[!#6&!#1])-[#6]=,:[#6]-1
PAINS Family A
Related compounds
Custom attributes
(extracted from source data)
Pathway
NF-¦ÊB
Immunology/Inflammation
Metabolic Enzyme/Protease
NF-κB
Target
Reactive Oxygen Species
ROS
Source data
