agatoxin 489

Ligand id: 2484

Name: agatoxin 489

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 7
Rotatable bonds 23
Topological polar surface area 130.47
Molecular weight 489.38
XLogP 0.53
No. Lipinski's rules broken 2

Molecular properties generated using the CDK
Classification
Compound class Natural product or derivative
IUPAC Name
N-[3-[3-[3-[4-(3-aminopropylamino)butylamino]propylamino]propyl-hydroxyamino]propyl]-2-(1H-indol-3-yl)acetamide
Synonyms
AG 489
Database Links
CAS Registry No. 128549-96-2 (source: Scifinder)
ChEMBL Ligand CHEMBL3286869
GtoPdb PubChem SID 53801092
PubChem CID 131007
Search Google for chemical match using the InChIKey LIURIBSBVUMOJS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LIURIBSBVUMOJS
Search UniChem for chemical match using the InChIKey LIURIBSBVUMOJS-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone LIURIBSBVUMOJS
Wikipedia Agatoxin_489