General
Preferred name
Polydatin
Synonyms
P&D ID
PD056344
CAS
27208-80-6
Tags
natural product
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
1
AdooQ Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
11
Properties
(calculated by RDKit )
Molecular Weight
390.13
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
6
Rotatable Bonds
5
Ring Count
3
Aromatic Ring Count
2
cLogP
0.45
TPSA
139.84
Fraction CSP3
0.3
Chiral centers
5.0
Largest ring
6.0
QED
0.4
Structural alerts
1
Nonspecific/NOS
Resveratrols
Nuisance compounds in cellular assays
Related compounds
Custom attributes
(extracted from source data)
Source data
