EcoDrugPlus


Synonyms	DU 126891 DU-126891 Pardoprunox SLV 308 SLV-308 SLV308
Status
Molecule Category	Free-form
UNII	5R72CHP32S

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Human Metabolites

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SubStructure

Threshold (%) >= 70


InChI Key	YVPUUUDAZYFFQT-UHFFFAOYSA-N
Smiles	CN1CCN(c2cccc3[nH]c(=O)oc23)CC1
InChI	InChI=1S/C12H15N3O2/c1-14-5-7-15(8-6-14)10-4-2-3-9-11(10)17-12(16)13-9/h2-4H,5-8H2,1H3,(H,13,16)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C12H15N3O2
Molecular Weight	233.27
AlogP	0.87
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	1.0
Polar Surface Area	52.48
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	17.0

Mechanism of Action	Action	Reference
Dopamine receptors; D2 & D3 partial agonist	PARTIAL AGONIST	PubMed

Target Conservation


Protein: Serotonin 1a (5-HT1a) receptor Description: 5-hydroxytryptamine receptor 1A Organism : Homo sapiens P08908 ENSG00000178394

Cross References

Resources	Reference
ChEMBL	CHEMBL2103832
DrugBank	DB12061
FDA SRS	5R72CHP32S
PubChem	6918525
SureChEMBL	SCHEMBL805311
ZINC	ZINC000000008736

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...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

PARDOPRUNOX

Structure

Physicochemical Descriptors

Pharmacology

Target Conservation

Related Entries

Cross References