General
Preferred name
XANTHOHUMOL
Synonyms
Xantho-flav ()
P&D ID
PD018575
CAS
6754-58-1
Tags
natural product
drug candidate
nuisance
available
Drug Status
investigational
Max Phase
2.0
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 Inactive isomer of GSK J1 (Cat. No. 4593) (Tocris Bioactive Compound Library)
Cell lines
14
Organisms
1
Compound Sets
10
Cayman Chemical Bioactives
ChEMBL Drugs
DrugBank
MedChem Express Bioactive Compound Library
Nuisance compounds in cellular assays
Other bioactive compounds
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
Tocris Bioactive Compound Library
External IDs
32
Properties
(calculated by RDKit )
Molecular Weight
354.15
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
3
Rotatable Bonds
6
Ring Count
2
Aromatic Ring Count
2
cLogP
4.22
TPSA
86.99
Fraction CSP3
0.19
Chiral centers
0.0
Largest ring
6.0
QED
0.41
Structural alerts
1
Nonspecific/NOS
Chalcone
Nuisance compounds in cellular assays
Custom attributes
(extracted from source data)
Pathway
Immunology/Inflammation
Neuroscience
Anti-infection
Apoptosis
Metabolic Enzyme/Protease
Target
COX
Acyltransferase
CMV
HSV
Influenza Virus
Acyltransferase,Apoptosis related,CMV,COX
Primary Target
p97 ATPase
MOA
Inhibitor
Source data