Drug General Information
Drug ID	D0H2SL
Former ID	DNC006921
Drug Name	2-(4-bromo-2-tert-butylphenoxy)acetic acid
Drug Type	Small molecular drug
Indication	Discovery agent		Investigative	[528566]
Structure		Download 2D MOL 3D MOL
Formula	C12H15BrO3
Canonical SMILES	CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)O
InChI	1S/C12H15BrO3/c1-12(2,3)9-6-8(13)4-5-10(9)16-7-11(14)15/h4-6H,7H2,1-3H3,(H,14,15)
InChIKey	GCBNGPDJYUPSBS-UHFFFAOYSA-N
PubChem Compound ID	719761
Target and Pathway
Target(s)	Putative G-protein coupled receptor 44	Target Info	Inhibitor	[528566]
Reactome	Prostanoid ligand receptors
	G alpha (i) signalling events
WikiPathways	GPCRs, Class A Rhodopsin-like
	GPCR ligand binding
	GPCR downstream signaling
References
Ref 528566	J Med Chem. 2006 Nov 16;49(23):6638-41.Novel selective orally active CRTH2 antagonists for allergic inflammation developed from in silico derived hits.
Ref 528566	J Med Chem. 2006 Nov 16;49(23):6638-41.Novel selective orally active CRTH2 antagonists for allergic inflammation developed from in silico derived hits.

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