Duo3

Ligand id: 7635

Name: Duo3

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 0
Rotatable bonds 12
Topological polar surface area 50.94
Molecular weight 602.08
XLogP 9.11
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(E)-N-[(2,6-dichlorophenyl)methoxy]-1-[1-[3-[4-[(E)-(2,6-dichlorophenyl)methoxyiminomethyl]pyridin-1-ium-1-yl]propyl]pyridin-1-ium-4-yl]methanimine
Synonyms
DUO3
Database Links
CAS Registry No. 736903-00-7 (source: Scifinder)
ChEMBL Ligand CHEMBL32985
GtoPdb PubChem SID 223365970
PubChem CID 10101670
Search Google for chemical match using the InChIKey RAHLDBGBLYIYDN-WKCPDWHCSA-N
Search Google for chemicals with the same backbone RAHLDBGBLYIYDN
Search UniChem for chemical match using the InChIKey RAHLDBGBLYIYDN-WKCPDWHCSA-N
Search UniChem for chemicals with the same backbone RAHLDBGBLYIYDN