General
Preferred name
MORUSIN
Synonyms
Mulberrochromene ()
TCMDC-124149 ()
P&D ID
PD063648
CAS
62596-29-6
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 ]]
Cell lines
6
Organisms
2
Compound Sets
3
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
23
Properties
(calculated by RDKit )
Molecular Weight
420.16
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
3
Rotatable Bonds
3
Ring Count
4
Aromatic Ring Count
3
cLogP
5.27
TPSA
100.13
Fraction CSP3
0.24
Chiral centers
0.0
Largest ring
6.0
QED
0.5
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
NF-¦ÊB
JAK/STAT Signaling
NF-??b
Anti-infection
NF-κB
Stem Cell/Wnt
Target
STAT3
NF-??B
NF-??
NF-¦ªb
Bacterial
MOA
STAT
Source data
