General
Preferred name
PNU-120596
Synonyms
PNU 120596 ()
NSC 216666 ()
PNU120596 ()
NSC 216666 (PNU 120596) ()
P&D ID
PD010911
CAS
501925-31-1
Tags
available
drug candidate
Drug indication
Discovery agent
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()] ]]
Description
(extracted from source data)
DESCRIPTION
Positive allosteric modulator of alpha7 nAChR; active in vivo
(Tocriscreen Plus)
DESCRIPTION
GABAA antagonist; more water soluble version of (+)-bicuculline (Cat. No. 0130)
(Tocris Bioactive Compound Library)
DESCRIPTION
Positive allosteric modulator of α7 nAChR; active in vivo
(Tocriscreen Total)
DESCRIPTION
PNU-120596 is a positive allosteric modulator of α7 nAChR with EC50 of 216 nM.
(BOC Sciences Bioactive Compounds)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
17
AdooQ Bioactive Compound Library
BOC Sciences Bioactive Compounds
Cayman Chemical Bioactives
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
Drug Repurposing Hub
DrugMAP
Enamine BioReference Compounds
Guide to Pharmacology
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
Tocris Bioactive Compound Library
Tocriscreen Plus
Tocriscreen Total
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
22
Molecular Weight
311.07
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
2
Rotatable Bonds
4
Ring Count
2
Aromatic Ring Count
2
cLogP
3.3
TPSA
85.62
Fraction CSP3
0.23
Chiral centers
0.0
Largest ring
6.0
QED
0.9
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target Type
Ion Channels
Pathway
Neuroscience
Membrane Transporter/Ion Channel
Neuronal Signaling
Target
??7 nAChR
CHRNA7
nAChR
AChR
Primary Target
Nicotinic (?7) Receptors
MOA
Modulator
acetylcholine receptor agonist
Source data
