Guanidine hydrochlorideProduct ingredient for Guanidine

Name
Guanidine hydrochloride
Drug Entry
Guanidine

A strong organic base existing primarily as guanidium ions at physiological pH. It is found in the urine as a normal product of protein metabolism. It is also used in laboratory research as a protein denaturant. (From Martindale, the Extra Pharmacopoeia, 30th ed and Merck Index, 12th ed) It is also used in the treatment of myasthenia and as a fluorescent probe in HPLC.

Accession Number
DBSALT000737
Structure
Synonyms
Guanidine HCl
UNII
3YQC9ZY4YB
CAS Number
50-01-1
Weight
Average: 95.531
Monoisotopic: 95.025024914
Chemical Formula
CH6ClN3
InChI Key
PJJJBBJSCAKJQF-UHFFFAOYSA-N
InChI
InChI=1S/CH5N3.ClH/c2-1(3)4;/h(H5,2,3,4);1H
IUPAC Name
guanidine hydrochloride
SMILES
Cl.NC(N)=N
PubChem Compound
5742
ChemSpider
5540
ChEBI
32735
ChEMBL
CHEMBL1200728
Wikipedia
Guanidinium_chloride
Predicted Properties
PropertyValueSource
Water Solubility11.5 mg/mLALOGPS
logP-1.9ALOGPS
logP-1.2Chemaxon
logS-0.71ALOGPS
pKa (Strongest Basic)12.55Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count3Chemaxon
Polar Surface Area75.89 Å2Chemaxon
Rotatable Bond Count0Chemaxon
Refractivity25.86 m3·mol-1Chemaxon
Polarizability5.57 Å3Chemaxon
Number of Rings0Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon