Ligand id: 4148

Name: CACA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 63.32
Molecular weight 101.05
XLogP -0.58
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Woodward RM, Polenzani L, Miledi R. (1993)
Characterization of bicuculline/baclofen-insensitive (rho-like) gamma-aminobutyric acid receptors expressed in Xenopus oocytes. II. Pharmacology of gamma-aminobutyric acidA and gamma-aminobutyric acidB receptor agonists and antagonists.
Mol. Pharmacol., 43 (4): 609-25. [PMID:8386310]