Drug Information

Drug General Information
Drug ID
D03NND
Former ID
DNC003594
Drug Name
N-(3-Benzooxazol-7-yl-propyl)-propionamide
Drug Type
Small molecular drug
Indication Discovery agent Investigative [527111]
Structure
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2D MOL

3D MOL
Formula
C13H16N2O2
Canonical SMILES
CCC(=O)NCCCC1=C2C(=CC=C1)N=CO2
InChI
1S/C13H16N2O2/c1-2-12(16)14-8-4-6-10-5-3-7-11-13(10)17-9-15-11/h3,5,7,9H,2,4,6,8H2,1H3,(H,14,16)
InChIKey
KCCKMLVZBSMOBW-UHFFFAOYSA-N
PubChem Compound ID
22718564
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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