General
Preferred name
SCH 442416
Synonyms
SCH-442416 ()
SCH442416 ()
P&D ID
PD016930
CAS
316173-57-6
Tags
available
drug candidate
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 SCH442416 is a potent, selective and brain-penetrant antagonist of adenosine A2A receptor (A2AR), with Kis of 0.048 and 0.5 nM for human and rat A2AR respectively. SCH442416 displays more than 23000-fold selectivity over A1R, A2BR, and A3R (Ki=1111, 10000, and 10000 nM, respectively). SCH442416 can be used for imaging of adenosine A2A receptors in rat and primate brain[1][2].
PRICE 116
DESCRIPTION SCH442416 (SCH 442416) is an selective antagonist of adenosine A2A receptor. SCH442416 binds to human and rat A2A receptors with high affinity (Ki values are 0.048 and 0.5 nM respectively). (TargetMol Bioactive Compound Library)
DESCRIPTION Potent, selective A1 agonist (Tocris Bioactive Compound Library)
Cell lines
0
Organisms
1
Compound Sets
13
Axon Medchem Screening Library
1264
Cayman Chemical Bioactives
22233
Concise Guide to Pharmacology 2017/18
3283
Concise Guide to Pharmacology 2019/20
3283
Concise Guide to Pharmacology 2021/22
3283
Concise Guide to Pharmacology 2023/24
3283
CZ-OPENSCREEN Bioactive Library
DrugMAP
DMQ2K1V
Guide to Pharmacology
3283
MedChem Express Bioactive Compound Library
HY-103169
Selleckchem Bioactive Compound Library
sch-442416
TargetMol Bioactive Compound Library
T23336
Tocris Bioactive Compound Library
2463
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
389.16
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
1
Rotatable Bonds
6
Ring Count
5
Aromatic Ring Count
5
cLogP
2.96
TPSA
109.29
Fraction CSP3
0.2
Chiral centers
0.0
Largest ring
6.0
QED
0.48
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Primary Target
Adenosine A2A Receptors
MOA
Antagonist
Pathway
GPCR/G protein
Neuroscience
Target
A2A antagonist
Adenosine Receptor
A2A
Source data