argiotoxin

Ligand id: 4138

Name: argiotoxin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 11
Rotatable bonds 28
Topological polar surface area 285.33
Molecular weight 636.41
XLogP -2.85
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
IUPAC Name
(2S)-N-(5-{[3-({3-[(2S)-2-amino-5-[(diaminomethylidene)amino]pentanamido]propyl}amino)propyl]amino}pentyl)-2-[2-(2,4-dihydroxyphenyl)acetamido]butanediamide
Synonyms
argiotoxin 636
Database Links
CAS Registry No. 105029-41-2 (source: Scifinder)
ChEMBL Ligand CHEMBL1098240
PubChem CID 122294
Search Google for chemical match using the InChIKey FTNICLJXPYLDAH-GOTSBHOMSA-N
Search Google for chemicals with the same backbone FTNICLJXPYLDAH
Wikipedia Argiotoxin
Comments
The structure shown here is representative of the argiotoxin group of compounds which are polyamine toxins extracted from the orb-weaver spider (Araneus gemma and Argiope lobata).