Ligand id: 8447

Name: 2-Cl-ADP(α-BH3)

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 5
Rotatable bonds 6
Topological polar surface area 231.99
Molecular weight 455
XLogP -3.71
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Azran S, Förster D, Danino O, Nadel Y, Reiser G, Fischer B. (2013)
Highly efficient biocompatible neuroprotectants with dual activity as antioxidants and P2Y receptor agonists.
J. Med. Chem., 56 (12): 4938-52. [PMID:23751098]