compound 23 [PMID: 17590335]

Ligand id: 6444

Name: compound 23 [PMID: 17590335]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 36.68
Molecular weight 262.09
XLogP 4.8
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-fluoro-5-(2-methylquinolin-7-yl)benzonitrile
Database Links
ChEMBL Ligand CHEMBL232188
PubChem CID 23661671
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Search UniChem for chemicals with the same backbone SDOLISUYGVMVBK