4-DAMP

Ligand id: 307

Name: 4-DAMP

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 26.3
Molecular weight 324.2
XLogP 6.81
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1,1-dimethylpiperidin-1-ium-4-yl) 2,2-di(phenyl)acetate
Synonyms
4-diphenylacetoxy-1,1-dimethylpiperidinium
Database Links
BindingDB Ligand 50223177
CAS Registry No. 81405-11-0 (source: Scifinder)
ChEMBL Ligand CHEMBL168067
GtoPdb PubChem SID 135649797
PubChem CID 1734
Search Google for chemical match using the InChIKey HYJRTXSYDAFGJK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone HYJRTXSYDAFGJK
Search UniChem for chemical match using the InChIKey HYJRTXSYDAFGJK-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone HYJRTXSYDAFGJK