C7/3-phth

Ligand id: 7634

Name: C7/3-phth

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 16
Topological polar surface area 74.76
Molecular weight 562.35
XLogP 4.98
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-(1,3-dioxoisoindol-2-yl)propyl-[7-[3-(1,3-dioxoisoindol-2-yl)propyl-dimethylazaniumyl]heptyl]-dimethylazanium
Synonyms
heptane-1,7-bis(dimethyl-3'-phthalimidopropylammonium)
Database Links
ChEMBL Ligand CHEMBL28407
PubChem CID 168057
Search Google for chemical match using the InChIKey OSALRKZRWVYPFR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone OSALRKZRWVYPFR
Search UniChem for chemical match using the InChIKey OSALRKZRWVYPFR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone OSALRKZRWVYPFR