compound 15 [PMID: 29852070]

Ligand id: 9997

Name: compound 15 [PMID: 29852070]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 133.06
Molecular weight 433.11
XLogP 1.92
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Comments
Compound 15 is an orally available PI3K inhibitor with selectivity for the PI3Kγ isoform [2]. This is a new isoindolinone chemotype that has not previously been used for the design of PI3K inhibitors.
Database Links
GtoPdb PubChem SID 374883884
Search Google for chemical match using the InChIKey PAQUFWFUOVDUIO-NSHDSACASA-N
Search Google for chemicals with the same backbone PAQUFWFUOVDUIO
Search UniChem for chemical match using the InChIKey PAQUFWFUOVDUIO-NSHDSACASA-N
Search UniChem for chemicals with the same backbone PAQUFWFUOVDUIO