NAV

Cyclocreatine

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Cyclocreatine
DrugBank Accession Number
DB17624
Background

Not Available

Type
Small Molecule
Groups
Investigational
Structure
3D
Similar Structures
Weight
Average: 143.146
Monoisotopic: 143.069476542
Chemical Formula
C5H9N3O2
Synonyms
  • 1-carboxymethyl-2-imino-imidazolidine
  • 2-imino-1-imidazolidineacetic acid
External IDs
  • AM-285
  • NSC-707961
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Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
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Not Available

Interactions

Drug Interactions Learn More" title="About Drug Interactions" id="structured-interactions-info" class="drug-info-popup" href="javascript:void(0);">
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Products

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Product Ingredients
IngredientUNIICASInChI Key
Cyclocreatine phosphate754W1VSR5W61839-19-8Not applicable

Categories

Drug Categories
Classification
Not classified
Affected organisms
Not Available

Chemical Identifiers

UNII
6732XGX1RK
CAS number
35404-50-3
InChI Key
AMHZIUVRYRVYBA-UHFFFAOYSA-N
InChI
InChI=1S/C5H9N3O2/c6-5-7-1-2-8(5)3-4(9)10/h1-3H2,(H2,6,7)(H,9,10)
IUPAC Name
2-(2-iminoimidazolidin-1-yl)acetic acid
SMILES
OC(=O)CN1CCNC1=N

References

General References
Not Available
Human Metabolome Database
HMDB0250642
ChemSpider
2793
ChEMBL
CHEMBL179900
ZINC
ZINC000001483569

Clinical Trials

Clinical Trials Learn More" title="About Clinical Trials" id="clinical-trials-info" class="drug-info-popup" href="javascript:void(0);">
PhaseStatusPurposeConditionsCount

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
logP-2.8Chemaxon
pKa (Strongest Acidic)3.37Chemaxon
pKa (Strongest Basic)11.93Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count5Chemaxon
Hydrogen Donor Count3Chemaxon
Polar Surface Area76.42 Å2Chemaxon
Rotatable Bond Count2Chemaxon
Refractivity44.82 m3·mol-1Chemaxon
Polarizability13.35 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
Not Available

Drug created at April 13, 2023 20:41 / Updated at September 28, 2023 05:48