seletalisib

Ligand id: 9800

Name: seletalisib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 90.53
Molecular weight 482.09
XLogP 5.6
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-{8-chloro-3-[(1R)-2,2,2-trifluoro-1-({pyrido[3,2-d]pyrimidin-4-yl}amino)ethyl]quinolin-2-yl}pyridin-1-ium-1-olate
Synonyms
UCB 5857 | UCB-5857 | UCB5857
Comments
Seletalisib is an orally bioavailable, potent and selective, ATP-competitive, small molecule inhibitor of PI3Kδ that is being developed by UCB Pharma for the treatment of immune and inflammatory diseases [1].
Database Links
GtoPdb PubChem SID 354702272
PubChem CID 56928390
Search Google for chemical match using the InChIKey LNLJHGXOFYUARS-OAQYLSRUSA-N
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Search UniChem for chemical match using the InChIKey LNLJHGXOFYUARS-OAQYLSRUSA-N
Search UniChem for chemicals with the same backbone LNLJHGXOFYUARS