Drug Information

Drug General Information
Drug ID
D0U3LA
Former ID
DNC006922
Drug Name
2-(2-benzoyl-4-bromophenoxy)acetic acid
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528566]
Structure
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2D MOL

3D MOL
Formula
C15H11BrO4
Canonical SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)OCC(=O)O
InChI
1S/C15H11BrO4/c16-11-6-7-13(20-9-14(17)18)12(8-11)15(19)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,18)
InChIKey
QCXHRPLPQPZWKP-UHFFFAOYSA-N
PubChem Compound ID
44417452
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 528566J 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 528566J 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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