compound 18 [PMID: 17723296]

Ligand id: 6443

Name: compound 18 [PMID: 17723296]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 71.69
Molecular weight 276.1
XLogP 2.78
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-methoxy-5-(7-methylpyrido[2,3-d]pyrimidin-2-yl)benzonitrile
Database Links
ChEMBL Ligand CHEMBL393843
PubChem CID 24180510
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