NAV

Tilorone

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

Identification

Generic Name
Tilorone
DrugBank Accession Number
DB17965
Background

Not Available

Type
Small Molecule
Groups
Investigational
Structure
3D
Similar Structures
Weight
Average: 410.558
Monoisotopic: 410.256942963
Chemical Formula
C25H34N2O3
Synonyms
Not Available
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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
Tilorone HydrochlorideBJ507J4LKY27591-69-1BSVYJQAWONIOOU-UHFFFAOYSA-N

Categories

ATC Codes
J05AX19 — Tilorone
Drug Categories
Classification
Not classified
Affected organisms
Not Available

Chemical Identifiers

UNII
O6W7VEW6KS
CAS number
27591-97-5
InChI Key
MPMFCABZENCRHV-UHFFFAOYSA-N
InChI
InChI=1S/C25H34N2O3/c1-5-26(6-2)13-15-29-19-9-11-21-22-12-10-20(30-16-14-27(7-3)8-4)18-24(22)25(28)23(21)17-19/h9-12,17-18H,5-8,13-16H2,1-4H3
IUPAC Name
2,7-bis[2-(diethylamino)ethoxy]-9H-fluoren-9-one
SMILES
CCN(CC)CCOC1=CC=C2C3=CC=C(OCCN(CC)CC)C=C3C(=O)C2=C1

References

General References
Not Available
Human Metabolome Database
HMDB0259096
ChemSpider
5276
BindingDB
50364890
ChEBI
147347
ChEMBL
CHEMBL47298
ZINC
ZINC000000538461
Wikipedia
Tilorone

Clinical Trials

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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
logP4.26Chemaxon
pKa (Strongest Basic)9.49Chemaxon
Physiological Charge2Chemaxon
Hydrogen Acceptor Count5Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area42.01 Å2Chemaxon
Rotatable Bond Count12Chemaxon
Refractivity123.67 m3·mol-1Chemaxon
Polarizability49.85 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon
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 July 07, 2023 23:05 / Updated at September 28, 2023 05:47