Ligand Id: 2625
Ligand name saxitoxin

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 11
Hydrogen bond donors 6
Rotatable bonds 3
Topological polar surface area 184.81
Molecular weight 299.13
XLogP -2.59
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
References
1. Bricelj, VM; Connell, L; Konoki, K; Macquarrie, SP; Scheuer, T; Catterall, WA; Trainer, VL. (2005)
Sodium channel mutation leading to saxitoxin resistance in clams increases risk of PSP.
Nature, 434 (7034): 763-7. [PMID:15815630]
2. Penzotti, JL; Lipkind, G; Fozzard, HA; Dudley, SC. (2001)
Specific neosaxitoxin interactions with the Na+ channel outer vestibule determined by mutant cycle analysis.
Biophys. J., 80 (2): 698-706. [PMID:11159437]
3. Zeng D, Kyle JW, Martin RL, Ambler KS, Hanck DA. (1996)
Cardiac sodium channels expressed in a peripheral neurotumor-derived cell line, RT4-B8.
Am J Physiol., 270 (5): C1522-31. [PMID:8967455]
4. Cribbs, LL; Satin, J; Fozzard, HA; Rogart, RB. (1990)
Functional expression of the rat heart I Na+ channel isoform. Demonstration of properties characteristic of native cardiac Na+ channels.
FEBS Lett., 275 (1-2): 195-200. [PMID:2175715]