ONO-AE2-227

Ligand id: 5824

Name: ONO-AE2-227

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 66.4
Molecular weight 409.17
XLogP 9.77
No. Lipinski's rules broken 1

Molecular properties generated using the CDK
Classification
Compound class Synthetic organic
IUPAC Name
2-[[2-(2-naphthalen-1-ylpropanoylamino)phenyl]methyl]benzoic acid
Database Links
CAS Registry No. 357605-73-3
ChEMBL Ligand CHEMBL3260772
GtoPdb PubChem SID 178102449
PubChem CID 5311232
Search Google for chemical match using the InChIKey BLJLWFKNTKAUDA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BLJLWFKNTKAUDA
Search UniChem for chemical match using the InChIKey BLJLWFKNTKAUDA-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BLJLWFKNTKAUDA