Drug Information

Drug General Information
Drug ID
D03AJW
Former ID
DNC003570
Drug Name
N-(3-Benzooxazol-7-yl-propyl)-butyramide
Drug Type
Small molecular drug
Indication Discovery agent Investigative [527111]
Structure
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2D MOL

3D MOL
Formula
C14H18N2O2
Canonical SMILES
CCCC(=O)NCCCC1=C2C(=CC=C1)N=CO2
InChI
1S/C14H18N2O2/c1-2-5-13(17)15-9-4-7-11-6-3-8-12-14(11)18-10-16-12/h3,6,8,10H,2,4-5,7,9H2,1H3,(H,15,17)
InChIKey
ADFZAUSXPZLXMN-UHFFFAOYSA-N
PubChem Compound ID
44349108
Target and Pathway
Target(s) Melatonin receptor type 1B Target Info Inhibitor [527111]
KEGG Pathway Neuroactive ligand-receptor interaction
Circadian entrainment
Reactome Class A/1 (Rhodopsin-like receptors)
G alpha (i) signalling events
WikiPathways GPCRs, Class A Rhodopsin-like
Small Ligand GPCRs
GPCR ligand binding
GPCR downstream signaling
References
Ref 527111Bioorg Med Chem Lett. 2004 Jul 16;14(14):3799-802.Synthesis and structure-activity relationship of novel benzoxazole derivatives as melatonin receptor agonists.
Ref 527111Bioorg Med Chem Lett. 2004 Jul 16;14(14):3799-802.Synthesis and structure-activity relationship of novel benzoxazole derivatives as melatonin receptor agonists.

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