Drug Information

Drug General Information
Drug ID
D09JKT
Former ID
DNC007897
Drug Name
2-acetylaminoquinazoline-4-carboxyanilide
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529186]
Structure
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2D MOL

3D MOL
Formula
C17H14N4O2
Canonical SMILES
CC(=O)NC1=NC2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3
InChI
1S/C17H14N4O2/c1-11(22)18-17-20-14-10-6-5-9-13(14)15(21-17)16(23)19-12-7-3-2-4-8-12/h2-10H,1H3,(H,19,23)(H,18,20,21,22)
InChIKey
BQZOPXKHGPNWQR-UHFFFAOYSA-N
PubChem Compound ID
24749707
Target and Pathway
Target(s) Adenosine A3 receptor Target Info Inhibitor [529186]
Reactome Adenosine P1 receptors
G alpha (i) signalling events
WikiPathways Nucleotide GPCRs
GPCRs, Class A Rhodopsin-like
GPCRs, Other
References
Ref 529186J Med Chem. 2007 Dec 27;50(26):6596-606. Epub 2007 Nov 30.Scouting human A3 adenosine receptor antagonist binding mode using a molecular simplification approach: from triazoloquinoxaline to a pyrimidine skeleton as a key study.
Ref 529186J Med Chem. 2007 Dec 27;50(26):6596-606. Epub 2007 Nov 30.Scouting human A3 adenosine receptor antagonist binding mode using a molecular simplification approach: from triazoloquinoxaline to a pyrimidine skeleton as a key study.

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