General
Preferred name
PD056577
Synonyms
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one ()
P&D ID
PD056577
Tags
available
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 Binding affinity to IL-2 (unknown origin) (TargetMol Bioactive Compound Library)
Compound Sets
1
TargetMol Bioactive Compound Library
External IDs
11
Properties
(calculated by RDKit )
Molecular Weight
448.1
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
7
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
3
cLogP
-0.24
TPSA
190.28
Fraction CSP3
0.29
Chiral centers
5.0
Largest ring
6.0
QED
0.26
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data