p-MPPI

Ligand id: 68

Name: p-MPPI

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 48.91
Molecular weight 542.12
XLogP 5.42
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-iodo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-ylbenzamide
Database Links
BindingDB Ligand 50035508
CAS Registry No. 155204-23-2 (source: Scifinder)
ChEMBL Ligand CHEMBL29027
PubChem CID 4658
Search Google for chemical match using the InChIKey DHMLNZRDVQLQBB-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DHMLNZRDVQLQBB
Search UniChem for chemical match using the InChIKey DHMLNZRDVQLQBB-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DHMLNZRDVQLQBB