General
Preferred name
MORIN
Synonyms
Al-Morin ()
Aurantica ()
Calico Yellow ()
Toxylon pomiferum ()
Morin Hydrate ()
Al-Morin, Aurantica, Calico Yellow, Toxylon pomiferum ()
NSC-19801 ()
P&D ID
PD001327
CAS
480-16-0
11128-85-1
6202-27-3
Tags
natural product
drug candidate
available
Drug indication
Discovery agent
Drug Status
experimental
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 Flavonoid with anti-oxidant properties; oxyradical scavenger (LOPAC library)
Cell lines
0
Organisms
2
Compound Sets
11
AdooQ Bioactive Compound Library
Drug Repurposing Hub
DrugBank
DrugMAP
Guide to Pharmacology
LOPAC library
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
The Spectrum Collection
ZINC Tool Compounds
External IDs
45
Properties
(calculated by RDKit )
Molecular Weight
302.04
Hydrogen Bond Acceptors
7
Hydrogen Bond Donors
5
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
3
cLogP
1.99
TPSA
131.36
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.46
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Selectivity
Antioxidant
Target
ADORA2A, ESR2, FASN, MCL1, SLC22A12
MOA
Cytochrome P450 inhibitor
Source data