aminoguanidine   

GtoPdb Ligand ID: 5135

Synonyms: amino guanidine | pimagedine
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 1
Topological polar surface area 87.92
Molecular weight 74.06
XLogP -1.07
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES NNC(=N)N
Isomeric SMILES NNC(=N)N
InChI InChI=1S/CH6N4/c2-1(3)5-4/h4H2,(H4,2,3,5)
InChI Key HAMNKKUPIHEESI-UHFFFAOYSA-N
Classification
Compound class Metabolite or derivative
IUPAC Name
1-aminoguanidine
International Nonproprietary Names
INN number INN
7088 pimagedine
Synonyms
amino guanidine | pimagedine
Database Links
CAS Registry No. 79-17-4
ChEBI CHEBI:40618
ChEMBL Ligand CHEMBL225304
DrugBank Ligand DB02533
GtoPdb PubChem SID 178101827
PubChem CID 2146
RCSB PDB Ligand AGU
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Wikipedia Aminoguanidine