General
Preferred name
Beta-methoxyamphetamine
Synonyms
Methoxyamphetamine ()
4-Methoxyamphetamine ()
METHOXYAMFETAMINE ()
PARA-METHOXYAMPHETAMINE ()
4-Methoxyamphetamine (hydrochloride) ()
4-Methoxyamphetamine (hydrochloride) (exempt preparation) ()
P&D ID
PD008842
CAS
3706-26-1
52740-56-4
23239-32-9
64-13-1
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
Drug Status
experimental
illicit
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
5
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
36
Properties
(calculated by RDKit )
Molecular Weight
165.12
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
3
Ring Count
1
Aromatic Ring Count
1
cLogP
1.58
TPSA
35.25
Fraction CSP3
0.4
Chiral centers
1.0
Largest ring
6.0
QED
0.74
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
