General
Preferred name
o-Hydroxybenzylamine
Synonyms
2-(Aminomethyl)phenol ()
2-Hydroxybenzylamine ()
2-HOBA ()
2-(Aminomethyl)phenol, 2-HOBA, NSC 127870 ()
2-(AMINOMETHYL)PHENOL ACETATE ()
2-hydroxylbenzylamine ()
2-Aminomethyl-Phenol ()
Salicylamine ()
NSC-127870 ()
2-hydroxybenzylamine acetate ()
Salicylamine acetate ()
P&D ID
PD085571
CAS
50312-64-6
932-30-9
Tags
available
drug candidate
Drug Status
investigational
Max Phase
1.0
2.0
Drug indication
Atrial fibrillation
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
2-(Aminomethyl)phenol (2-Hydroxybenzylamine), a selective dicarbonyl scavenger, is an antioxidant and scavanger of free radicals and isolevuglandins (IsoLGs). 2-(Aminomethyl)phenol can be used in the research of inflammation and cardiovascular disease, such as atherosclerosis, early recurrence of atrial fibrillation (AF) and arrhythmias[1][2].
PRICE
29
DESCRIPTION
2-Hydroxybenzylamine, a potent small molecule scavenger of IsoLGs, sequesters the reactive species as inert adducts. 2-Hydroxybenzylamine may be used to decrease early recurrence of atrial fibrillation and other atrial arrhythmias following atrial fibrillation ablation by decreasing IsoLG adducts with native biomolecules.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
6
Cayman Chemical Bioactives
ChEMBL Drugs
DrugBank
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
29
Molecular Weight
123.07
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
0.85
TPSA
46.25
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
6.0
QED
0.58
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Reactive Oxygen Species (ROS)
Immunology & Inflammation related
Reactive Oxygen Species
Pathway
Immunology/Inflammation
Metabolic Enzyme/Protease
NF-κB
NF-¦ÊB
Source data
