General
Preferred name
hydroquinine
Synonyms
HYDROQUINIDINE ()
P&D ID
PD072019
CAS
522-66-7
Tags
natural product
drug
available
Drug Status
experimental
approved
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 ]]
Cell lines
2
Organisms
0
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
20
Properties
(calculated by RDKit )
Molecular Weight
326.2
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
4
Ring Count
5
Aromatic Ring Count
2
cLogP
3.4
TPSA
45.59
Fraction CSP3
0.55
Chiral centers
5.0
Largest ring
6.0
QED
0.94
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Reactive Oxygen Species
Pathway
Metabolic Enzyme/Protease
NF-¦ÊB
Immunology/Inflammation
Source data
