compound 7 [WO2012007375]

Ligand id: 8085

Name: compound 7 [WO2012007375]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 134.5
Molecular weight 408.14
XLogP 1.46
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[(2-aminoethyl)(methyl)amino]-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
Database Links
GtoPdb PubChem SID 249565765
PubChem CID 58056092
Search Google for chemical match using the InChIKey BUJSZRICYLPWCM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BUJSZRICYLPWCM
Search UniChem for chemical match using the InChIKey BUJSZRICYLPWCM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BUJSZRICYLPWCM
Comments
This compound is a potent and somewhat selective inhibitor of IRAK4, described in patent WO2012007375 [1].