VU0361737

Ligand id: 3956

Name: VU0361737

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 51.22
Molecular weight 262.05
XLogP 2.37
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Ligand Activity Visualisation Charts

These are box plot that provide a unique visualisation, summarising all the activity data for a ligand taken from ChEMBL and GtoPdb across multiple targets and species. Click on a plot to see the median, interquartile range, low and high data points. A value of zero indicates that no data are available. A separate chart is created for each target, and where possible the algorithm tries to merge ChEMBL and GtoPdb targets by matching them on name and UniProt accession, for each available species. However, please note that inconsistency in naming of targets may lead to data for the same target being reported across multiple charts.

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View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Classification
Compound class Synthetic organic
IUPAC Name
N-(4-chloro-3-methoxyphenyl)pyridine-2-carboxamide
Synonyms
compound 9b [PMID: 19469556] [1] | VU 0361737 | VU-0361737
Database Links
CAS Registry No. 1161205-04-4 (source: Scifinder)
ChEMBL Ligand CHEMBL562551
GtoPdb PubChem SID 178100783
PubChem CID 44191096
Search Google for chemical match using the InChIKey ARYUXFNGXHNNDM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ARYUXFNGXHNNDM
Search UniChem for chemical match using the InChIKey ARYUXFNGXHNNDM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ARYUXFNGXHNNDM

Product suppliers

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Links are provided in return for sponsorship, used to fund improvements to this database. The sponsorship account is managed and audited by the University of Edinburgh, a charitable body registered in Scotland, SC005336. If you are interested in sponsoring the database, please contact us.

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Tocris
VU 0361737
Cat. No. 3707