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ML 289 - ≥98%(HPLC), high purity , CAS No.1382481-79-9, Allosteric modulator of mGlu 3 receptor

Moligand™
≥98%(HPLC)

CAS#: 1382481-79-9
Formula: C₂₂H₂₃NO₃
Molecular Weight: 349.42
PubChem CID: 56587994
PubChem SID: 488201732

Item Number

M288508

Grouped product items
SKU	Size	Availability	Price
M288508-5mg	5mg	In stock	$98.90
M288508-10mg	10mg	In stock	$157.90
M288508-25mg	25mg	In stock	$315.90
M288508-50mg	50mg	In stock	$513.90
M288508-100mg	100mg	In stock	$820.90

Selective negative allosteric modulator of mGlu3receptors

View related series

mGlu3 receptor Allosteric modulator

Basic Description

Synonyms	1382481-79-9\|ML289\|ML 289\|VU0463597\|ml-289\|[(3R)-1-({4-[2-(4-methoxyphenyl)ethynyl]phenyl}carbonyl)piperidin-3-yl]methanol\|(R)-VU0463597\|CHEMBL2204445\|[(3R)-3-(Hydroxymethyl)-1-piperidinyl][4-[2-(4-methoxyphenyl)ethynyl]phenyl]-methanone\|[(3R)-3-(Hydroxym
Specifications & Purity	Moligand™, ≥98%(HPLC)
Biochemical and Physiological Mechanisms	Selective negative allosteric modulator at mGlu3receptors (IC50= 660 nM). Exhibits 15-fold selectivity for mGlu3over mGlu2. Centrally penetrant.
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads
Grade	Moligand™
Action Type	ALLOSTERIC MODULATOR
Mechanism of action	Allosteric modulator of mGlu 3 receptor

Associated Targets

CYP1A2 Tchem Cytochrome P450 1A2 0 Activities

Discover Target: CYP1A2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP2D6 Tclin Cytochrome P450 2D6 0 Activities

Discover Target: CYP2D6

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP3A4 Tclin Cytochrome P450 3A4 0 Activities

Discover Target: CYP3A4

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP2C9 Tchem Cytochrome P450 2C9 0 Activities

Discover Target: CYP2C9

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

GRM2 Tchem Metabotropic glutamate receptor 2 0 Activities

Discover Target: GRM2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

GRM5 Tchem Metabotropic glutamate receptor 5 0 Activities

Discover Target: GRM5

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

GRM3 Tchem Metabotropic glutamate receptor 3 0 Activities

Discover Target: GRM3

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

Pubchem Sid	488201732
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488201732
IUPAC Name	[(3R)-3-(hydroxymethyl)piperidin-1-yl]-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]methanone
INCHI	InChI=1S/C22H23NO3/c1-26-21-12-8-18(9-13-21)5-4-17-6-10-20(11-7-17)22(25)23-14-2-3-19(15-23)16-24/h6-13,19,24H,2-3,14-16H2,1H3/t19-/m1/s1
InChi Key	VSLWUPHHCFQTDB-LJQANCHMSA-N
Canonical SMILES	COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)N3CCCC(C3)CO
Isomeric SMILES	COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)N3CCC[C@H](C3)CO
PubChem CID	56587994
Molecular Weight	349.42

CAS Registry No.

PubChem CID

ChEMBL Ligand

GPCRdb Ligand

PubChem SID

Certificates

Certificate of Analysis(COA)

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10 results found

Lot Number	Certificate Type	Date	Item
C2329307	Certificate of Analysis	Jan 03, 2023	M288508
C2329308	Certificate of Analysis	Jan 03, 2023	M288508
C2329309	Certificate of Analysis	Jan 03, 2023	M288508
C2329310	Certificate of Analysis	Jan 03, 2023	M288508
C2329320	Certificate of Analysis	Jan 03, 2023	M288508
C2329321	Certificate of Analysis	Jan 03, 2023	M288508
C2329322	Certificate of Analysis	Jan 03, 2023	M288508
C2329332	Certificate of Analysis	Jan 03, 2023	M288508
C2329418	Certificate of Analysis	Jan 03, 2023	M288508
C2329419	Certificate of Analysis	Jan 03, 2023	M288508

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.

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