4-Methylhistamine - Moligand™,≥95% , Agonist of H 4 receptor, CAS No.36507-31-0, Agonist of H 4 receptor

CAS: 36507-31-0 Cat. No.: M607190 분자식: C₆H₁₁N₃ 분자량: 125.17 EC 번호: 635-740-9

GRADE & PURITY Moligand™, ≥95%

Synonyms

2-(5-Methyl-4-imidazolyl)ethylamine | 2-(5-methyl-1H-imidazol-4-yl)ethanamine | FT-0736440 | IMIDAZOLE, 4-(2-AMINOETHYL)-5-METHYL- | GTPL1269 | Methylhistamine-4 | PDSP1_000400 | 2-(5-METHYL-3H-IMIDAZOL-4-YL)-ETHYLAMINE | C17929 | 5-(2-Aminoethyl)-4-methy

Storage

Room temperature,Argon charged

Shipped In

Normal

개요

4-Methylhistamine is a potent and selective agonist of histamine 4 receptor (H4R) with a Ki of 50 nM. 4-Methylhistamine has a >100-fold selectivity for the hH4R over the other histamine receptor subtypes. 4-Methylhistamine can potently activate the hH4R (pEC50 = 7.4). 4-Methylhistamine can be used for the researches of cancer, inflammation and immunology, such as lung cancer and skin inflammation

Specifications

동의어

2-(5-Methyl-4-imidazolyl)ethylamine | 2-(5-methyl-1H-imidazol-4-yl)ethanamine | FT-0736440 | IMIDAZOLE, 4-(2-AMINOETHYL)-5-METHYL- | GTPL1269 | Methylhistamine-4 | PDSP1_000400 | 2-(5-METHYL-3H-IMIDAZOL-4-YL)-ETHYLAMINE | C17929 | 5-(2-Aminoethyl)-4-methy

사양 및 순도

Moligand™,≥95%

보관 조건

Room temperature,Argon charged

배송

Normal

등급

Moligand™

작업 유형

AGONIST

작동 메커니즘

Agonist of H 4 receptor

순수함

≥95%

제품 특성

ALogP

-0.2

이름과 식별자

정식 스마일

Cc1c(CCN)nc[nH]1

IUPAC Name

2-(5-methyl-1H-imidazol-4-yl)ethanamine

InChIKey

UGYXPZQILZRKJJ-UHFFFAOYSA-N

INCHI

1S/C6H11N3/c1-5-6(2-3-7)9-4-8-5/h4H,2-3,7H2,1H3,(H,8,9)

이성체 SMILES

CC1=C(N=CN1)CCN

대체 CAS

36376-47-3

분자량

125.17

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • 분류 Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 2-arylethylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 분류: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: 2-arylethylamines
• Alternative Parents: Aralkylamines Imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-arylethylamine - Aralkylamine - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organoheterocyclic compound - Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aromatic heteromonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as 2-arylethylamines. These are primary amines that have the general formula RCCNH2, where R is an organic group.
• External Descriptors: a small molecule

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

관련 대상(인간)

HRH4 Tchem Histamine H4 receptor (4 Activities)

Discover Target: HRH4

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

HRH2 Tclin Histamine H2 receptor (5428 Activities)

Discover Target: HRH2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HRH1 Tclin Histamine H1 receptor (7573 Activities)

Discover Target: HRH1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HRH3 Tclin Histamine H3 receptor (10389 Activities)

Discover Target: HRH3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

관련 대상(비인간)

Hrh4 Histamine H4 receptor (388 Activities)

Discover Target: Hrh4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Rattus norvegicus (775804 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

작용 메커니즘

화학 및 물리적 특성

• 분자량: 125.170 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 125.095 Da
• Monoisotopic Mass: 125.095 Da
• Topological Polar Surface Area: 54.700 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 84.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1