MOXONIDINE

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Search structure


Synonyms	BDF-5896 BDF5896 BE-5895 BE5895 Cynt Fisiotens LY-326869 LY326869 Moxonidine Norcynt Normatens Nucynt Physiotens
Status
Molecule Category	Free-form
ATC	C02AC05
UNII	CC6X0L40GW
EPA CompTox	DTXSID5045170

Structure


InChI Key	WPNJAUFVNXKLIM-UHFFFAOYSA-N
Smiles	COc1nc(C)nc(Cl)c1NC1=NCCN1
InChI	InChI=1S/C9H12ClN5O/c1-5-13-7(10)6(8(14-5)16-2)15-9-11-3-4-12-9/h3-4H2,1-2H3,(H2,11,12,15)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C9H12ClN5O
Molecular Weight	241.68
AlogP	0.82
Hydrogen Bond Acceptor	6.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	2.0
Polar Surface Area	71.43
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	16.0

Pharmacology

Mechanism of Action	Action	Reference
Nischarin agonist	AGONIST	PubMed PubMed PubMed

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor	-	-	-	75-150	-
Other cytosolic protein	-	3.548	-	4.198-77.8	-

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Bos taurus	-	-	-	56	-
Homo sapiens	-	3.548	-	0.2-150	-
Rattus norvegicus	-	-	-	77.8	-

Target Conservation


Protein: Nischarin Description: Nischarin Organism : Homo sapiens Q9Y2I1 ENSG00000010322

Cross References

Resources	Reference
ChEBI	7009
ChEMBL	CHEMBL19236
DrugBank	DB09242
DrugCentral	1856
FDA SRS	CC6X0L40GW
Human Metabolome Database	HMDB0041938
KEGG	C07451
PubChem	4810
SureChEMBL	SCHEMBL49143
ZINC	ZINC000001854466

CONTENTS

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

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Last update: Monday, 3 November 2025