General
Preferred name
IDEANIN
Synonyms
Cyanidin-3-O-galactoside (chloride) ()
Ideain (chloride) ()
Cyanidin 3-O-?-D-Galactopyranoside (chloride) ()
P&D ID
PD094822
CAS
128808-27-5
27661-36-5
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
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
11
Properties
(calculated by RDKit )
Molecular Weight
484.08
Hydrogen Bond Acceptors
10
Hydrogen Bond Donors
8
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
3
cLogP
-2.61
TPSA
191.6
Fraction CSP3
0.29
Chiral centers
5.0
Largest ring
6.0
QED
0.14
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Neuronal Signaling
Target
Cholinesterase (ChE)
Source data
