General
Preferred name
SINAPIC ACID
Synonyms
Synapoic acid ()
Sinapinic Acid ()
Sinapic Acid ()
SINAPINATE ()
P&D ID
PD002495
CAS
530-59-6
7362-37-0
Tags
drug candidate
natural product
available
Drug Status
experimental
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 ]]
Compound Sets
7
Cayman Chemical Bioactives
DrugBank
MedChem Express Bioactive Compound Library
Novartis Chemogenetic Library (NIBR MoA Box)
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
The Spectrum Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
35
Properties
(calculated by RDKit )
Molecular Weight
224.07
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
4
Ring Count
1
Aromatic Ring Count
1
cLogP
1.51
TPSA
75.99
Fraction CSP3
0.18
Chiral centers
0.0
Largest ring
6.0
QED
0.76
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
NF-¦ÊB
DNA Damage/DNA Repair
Chromatin/Epigenetic
Metabolism
Apoptosis
Cell Cycle/DNA Damage
Epigenetics
Immunology/Inflammation
Metabolic Enzyme/Protease
NF-κB
Target
ACE
HDAC
Angiotensin-converting Enzyme (ACE)
Reactive Oxygen Species
ACE,HDAC
MOA
RAAS
GABA(A) Receptor Agonists
Antioxidants
Alleviation of Cartilage Destruction
Member status
virtual
Source data
