CI-966

Ligand id: 4612

Name: CI-966

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 49.77
Molecular weight 473.14
XLogP 6.48
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

References
1. Borden LA, Murali Dhar TG, Smith KE, Weinshank RL, Branchek TA, Gluchowski C. (1994)
Tiagabine, SK&F 89976-A, CI-966, and NNC-711 are selective for the cloned GABA transporter GAT-1.
Eur. J. Pharmacol.269 (2): 219-24. [PMID:7851497]