Ligand Id: 1693
Ligand name SB 612111

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 23.47
Molecular weight 417.16
XLogP 6.82
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
References
1. Zaratin, P. F., Petrone, G., Sbacchi, M., Garnier, M., Fossati, C., Petrillo, P., Ronzoni, S., Giardina, G. A. and Scheideler, M. A. (2004)
Modification of nociception and morphine tolerance by the selective opiate receptor-like orphan receptor antagonist (-)-cis-1-methyl-7-[[4-(2,6-dichlorophenyl)piperidin-1-yl]methyl]-6,7,8,9-tetrahydro-5H-benzocyclohepten-5-ol (SB-612111).
J Pharmacol Exp Ther, 308: 454-461. [PMID:14593080]