General
Preferred name
WDuo3
Synonyms
P&D ID
PD051710
Tags
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
Guide to Pharmacology
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
5
Properties
(calculated by RDKit )
Molecular Weight
604.21
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
0
Rotatable Bonds
12
Ring Count
6
Aromatic Ring Count
4
cLogP
2.56
TPSA
125.7
Fraction CSP3
0.15
Chiral centers
0.0
Largest ring
6.0
QED
0.11
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
