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MRL-871 , CAS No.1392809-08-3, Agonist of RAR-related orphan receptor-γ

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MRL-871 , CAS No.1392809-08-3, Agonist of RAR-related orphan receptor-γ

Moligand™

CAS#: 1392809-08-3
Formula: C₂₂H₁₂ClF₃N₂O₃
Molecular Weight: 444.79
PubChem CID: 68159303

Item Number

M612023

Grouped product items
SKU	Size	Availability	Price	Qty
M612023-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$229.90
M612023-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$916.90

View related series

RAR-related orphan receptor-γ Agonist

Basic Description

Synonyms	MRL871
Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	AGONIST
Mechanism of action	Agonist of RAR-related orphan receptor-γ

Associated Targets(Human)

RORC Tchem Nuclear receptor ROR-gamma (13 Activities)

Discover Target: RORC

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

PPARG Tclin Peroxisome proliferator-activated receptor gamma (15191 Activities)

Discover Target: PPARG

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

Associated Targets(non-human)

Rorc Nuclear receptor ROR-gamma (89407 Activities)

Discover Target: Rorc

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

Names and Identifiers

IUPAC Name	4-[1-[2-chloro-6-(trifluoromethyl)benzoyl]indazol-3-yl]benzoic acid
INCHI	InChI=1S/C22H12ClF3N2O3/c23-16-6-3-5-15(22(24,25)26)18(16)20(29)28-17-7-2-1-4-14(17)19(27-28)12-8-10-13(11-9-12)21(30)31/h1-11H,(H,30,31)
InChi Key	DANLZOIRUUHIIX-UHFFFAOYSA-N
Canonical SMILES	C1=CC=C2C(=C1)C(=NN2C(=O)C3=C(C=CC=C3Cl)C(F)(F)F)C4=CC=C(C=C4)C(=O)O
Isomeric SMILES	C1=CC=C2C(=C1)C(=NN2C(=O)C3=C(C=CC=C3Cl)C(F)(F)F)C4=CC=C(C=C4)C(=O)O
PubChem CID	68159303
Molecular Weight	444.79

Database links

PubChem CID	68159303
ChEMBL Ligand	CHEMBL3598140
RCSB PDB Ligand	4F1
BindingDB Ligand	50106301
CAS Registry No.	1392809-08-3

Certificates

Certificate of Analysis(COA)

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References

1. Scheepstra M, Leysen S, van Almen GC, Miller JR, Piesvaux J, Kutilek V, van Eenennaam H, Zhang H, Barr K, Nagpal S et al.. (2015) Identification of an allosteric binding site for RORγt inhibition.. Nat Commun, 6 (3): (8833). [PMID:26640126]

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