General
Preferred name
L-Cysteinesulfinic Acid
Synonyms
3-sulfino-L-alanine ()
3-Sulfinoalanine ()
Double Oxidized Cysteine ()
L-Cysteinesulfinic acid (monohydrate) ()
L-cysteine sulphinic acid ()
L-Cysteinesulfinic Acid (hydrate) ()
P&D ID
PD002778
CAS
1115-65-7
207121-48-0
Tags
drug candidate
natural product
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 Putative excitatory amino acid neurotransmitter (LOPAC library)
DESCRIPTION NMDA and mGlu agonist (Tocriscreen Total)
DESCRIPTION L-Cysteinesulfinic acid is an agonist of mGlu1a and mGlu5a subtypes expressed in clonal RGT cell lines and an agonist of NMDA. It is used to probe conformational flexibility of human DJ-1, which is very important in protecting against oxidative stress and other factors contributing to Parkinson's. It is putative excitatory amino acid neurotransmitter. (BOC Sciences Bioactive Compounds)
Compound Sets
9
BOC Sciences Bioactive Compounds
l-cysteinesulfinic-acid-cas-1115-65-7-item-72191
Cayman Chemical Bioactives
29597
Drug Repurposing Hub
DrugBank
DB02153
DrugMAP
DMILTRN
DM6TU84
Guide to Pharmacology
5447
LOPAC library
MedChem Express Bioactive Compound Library
HY-100804
HY-W017230
Tocriscreen Total
External IDs
55
Properties
(calculated by RDKit )
Molecular Weight
153.01
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
3
Rotatable Bonds
3
Ring Count
0
Aromatic Ring Count
0
cLogP
-1.38
TPSA
100.62
Fraction CSP3
0.67
Chiral centers
2.0
Largest ring
0.0
QED
0.43
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
GRM1, GRM5, GSR, HMGCS2, PAPOLA, PRDX2
Endogenous Metabolite
mGluR
MOA
glutamate receptor agonist
Pathway
GPCR/G protein
Metabolic Enzyme/Protease
Neuronal Signaling
Source data