General
Preferred name
N1-Acetylspermine (hydrochloride)
Synonyms
N1-Acetylspermine (trihydrochloride) ()
P&D ID
PD044917
CAS
25593-72-0
77928-70-2
Tags
available
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
2
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
26
Properties
(calculated by RDKit )
Molecular Weight
244.23
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
4
Rotatable Bonds
12
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.18
TPSA
79.18
Fraction CSP3
0.92
Chiral centers
0.0
Largest ring
0.0
QED
0.36
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data
