4,9-anhydro-tetrodotoxin

Ligand id: 5730

Name: 4,9-anhydro-tetrodotoxin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 7
Rotatable bonds 1
Topological polar surface area 158.26
Molecular weight 302.1
XLogP -3.37
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Synonyms
4,9-ah-TTX
4,9-anhydro-TTX
Database Links
PubChem CID 73755148
Search Google for chemical match using the InChIKey STNXQECXKDMLJK-UHFFFAOYSA-O
Search Google for chemicals with the same backbone STNXQECXKDMLJK