AGN193109

Ligand id: 2640

Name: AGN193109

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 37.3
Molecular weight 392.18
XLogP 12.52
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[2-[5,5-dimethyl-8-(4-methylphenyl)-6H-naphthalen-2-yl]ethynyl]benzoic acid
Synonyms
AGN 193109
AGN-93109
Database Links
BindingDB Ligand 50029774
ChEMBL Ligand CHEMBL358145
NURSA Ligand 10.1621/WHCEK9TVKL
PubChem CID 177238
Search Google for chemical match using the InChIKey NCEQLLNVRRTCKJ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NCEQLLNVRRTCKJ