TAK-779

Ligand id: 783

Name: TAK-779

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 38.33
Molecular weight 495.3
XLogP 9.91
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
dimethyl-[[4-[[3-(4-methylphenyl)8,9-dihydro-7H-benzo[7]annulene-6-carbonyl]amino]phenyl]methyl]-(oxan-4-yl)azanium
Synonyms
TAK779
Database Links
CAS Registry No. 263765-56-6 (source: Scifinder)
ChEMBL Ligand CHEMBL1178786
PubChem CID 183790
Search Google for chemical match using the InChIKey XNHZXMPLVSJQFK-UHFFFAOYSA-O
Search Google for chemicals with the same backbone XNHZXMPLVSJQFK
Search UniChem for chemical match using the InChIKey XNHZXMPLVSJQFK-UHFFFAOYSA-O
Search UniChem for chemicals with the same backbone XNHZXMPLVSJQFK