General
Preferred name
EB-3D
Synonyms
P&D ID
PD127546
CAS
1839150-63-8
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 ]]
Cell lines
0
Organisms
1
Compound Sets
3
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
11
Properties
(calculated by RDKit )
Molecular Weight
484.28
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
11
Ring Count
4
Aromatic Ring Count
4
cLogP
3.95
TPSA
32.7
Fraction CSP3
0.27
Chiral centers
0.0
Largest ring
6.0
QED
0.24
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Neuroscience
Apoptosis
Epigenetics
PI3K/Akt/mTOR
Target
choline kinase alpha 1 (ChoK??1)?
AMPK
AMPK,Apoptosis related,Choline kinase
Source data
