General
Preferred name
compound 5b [PMID: 24900464]
Synonyms
P&D ID
PD051225
Tags
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Compound 5b is one of the analogues designed in a medicinal chemistry study to identify inhibitors of casein kinase 2 (CK2) . (GtoPdb)
Cell lines
2
Organisms
0
Compound Sets
1
Guide to Pharmacology
External IDs
8
Properties
(calculated by RDKit )
Molecular Weight
371.15
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
3
Rotatable Bonds
4
Ring Count
5
Aromatic Ring Count
4
cLogP
3.28
TPSA
110.9
Fraction CSP3
0.2
Chiral centers
0.0
Largest ring
6.0
QED
0.51
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data