agmatine

Ligand id: 4127

Name: agmatine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 90.42
Molecular weight 130.12
XLogP -0.9
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
2-(4-aminobutyl)guanidine
Database Links
CAS Registry No. 306-60-5 (source: Scifinder)
ChEBI CHEBI:17431
ChEMBL Ligand CHEMBL58343
Human Metabolome Database HMDB01432
PubChem CID 199
RCSB PDB Ligand AG2
Search Google for chemical match using the InChIKey QYPPJABKJHAVHS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QYPPJABKJHAVHS
Wikipedia Agmatine