compound C2 [PMID: 29990428]

Ligand id: 10273

Name: compound C2 [PMID: 29990428]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 51.1
Molecular weight 434.1
XLogP 6.31
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-{5-bromo-1-[(4-fluorophenyl)methyl]-4-methyl-2-oxo-1,2-dihydropyridin-3-yl}cycloheptanecarboxamide
Synonyms
Ec2la
Comments
C2 is a positive allosteric modulator (PAM) that targets CB2 receptors. It has reported antinociceptive efficacy in an animal model of neuropathic pain [1].
Database Links
GtoPdb PubChem SID 381744954
PubChem CID 137553165
Search Google for chemical match using the InChIKey NSGDYZCDUPSTQT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NSGDYZCDUPSTQT
Search UniChem for chemical match using the InChIKey NSGDYZCDUPSTQT-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NSGDYZCDUPSTQT