ASP-3026

Ligand id: 7740

Name: ASP-3026

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 124.2
Molecular weight 580.29
XLogP 4.23
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-4-N-(2-propan-2-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine
Synonyms
ASP 3026 | ASP3026
Database Links
CAS Registry No. 1097917-15-1
GtoPdb PubChem SID 223366073
PubChem CID 25134326
Search Google for chemical match using the InChIKey MGGBYMDAPCCKCT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MGGBYMDAPCCKCT
Search UniChem for chemical match using the InChIKey MGGBYMDAPCCKCT-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone MGGBYMDAPCCKCT
Comments
ASP-3026 is a second generation ALK inhibitor designed to target ALK rearrangements which are the oncogenic drivers of some non-small cell lung cancers (NSCLCs) and T-cell lymphomas known as ALK- expressing anaplastic large-cell lymphoma (ALK+ALCL) .