[3H]A-585539

Ligand id: 3974

Name: [3H]A-585539    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 29.02
Molecular weight 281.18
XLogP 3.69
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2,2-dimethyl-5-(6-phenylpyridazin-3-yl)-2,5-diazabicyclo[2.2.1]heptan-2-ium
Database Links
ChEMBL Ligand CHEMBL2068882
GtoPdb PubChem SID 178100800
PubChem CID 23643135
Search Google for chemical match using the InChIKey AKMKIDQMKPFYDJ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AKMKIDQMKPFYDJ
Search UniChem for chemical match using the InChIKey AKMKIDQMKPFYDJ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AKMKIDQMKPFYDJ