General
Preferred name
N1-Acetylspermidine (hydrochloride)
Synonyms
N1-Acetylspermidine hydrochloride ()
P&D ID
PD046294
CAS
14278-49-0
34450-16-3
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 202
DESCRIPTION N1-Acetylspermidine hydrochloride, an acetyl derivative of spermidine, serves as a substrate for polyamine oxidase and selectively elevates its levels in human colorectal adenocarcinomas.
Compound Sets
2
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
External IDs
33
Properties
(calculated by RDKit )
Molecular Weight
187.17
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
3
Rotatable Bonds
8
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.16
TPSA
67.15
Fraction CSP3
0.89
Chiral centers
0.0
Largest ring
0.0
QED
0.46
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Apoptosis
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data