This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- PBT-1033
- DrugBank Accession Number
- DB05565
- Background
Not Available
- Type
- Small Molecule
- Groups
- Investigational
- Structure
Structure for PBT-1033 (DB05565)
- Weight
- Average: 271.14
Monoisotopic: 270.0326684 - Chemical Formula
- C12H12Cl2N2O
- Synonyms
- 5,7-dichloro-2-(dimethylaminomethyl)quinolin-8-ol
- 8-quinolinol, 5,7-dichloro-2-((dimethylamino)methyl)-
- External IDs
- PB 1033
- PBT-2
- PBT2
Pharmacology
- Indication
Investigated for use/treatment in alzheimer's disease.
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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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Not Available
- Pathways
- Not Available
- Pharmacogenomic Effects/ADRs
- Not Available
Interactions
- Drug Interactions
- 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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Ingredient UNII CAS InChI Key PBT-1033 hydrochloride 24Z79C941B 648896-70-2 Not applicable
Categories
- Drug Categories
- Not Available
- Classification
- Not classified
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- Q7K6GJQ4O4
- CAS number
- 747408-78-2
- InChI Key
- YZPOQCQXOSEMAZ-UHFFFAOYSA-N
- InChI
- InChI=1S/C12H12Cl2N2O/c1-16(2)6-7-3-4-8-9(13)5-10(14)12(17)11(8)15-7/h3-5,17H,6H2,1-2H3
- IUPAC Name
- 5,7-dichloro-2-[(dimethylamino)methyl]quinolin-8-ol
- SMILES
- CN(C)CC1=CC=C2C(Cl)=CC(Cl)=C(O)C2=N1
References
- General References
- Not Available
- External Links
- Human Metabolome Database
- HMDB0256151
- ChemSpider
- 8191585
- ChEMBL
- CHEMBL3634131
Clinical Trials
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
- Not Available
- Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Solid
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 0.355 mg/mL ALOGPS logP 3.23 ALOGPS logP 1.85 Chemaxon logS -2.9 ALOGPS pKa (Strongest Acidic) 6.77 Chemaxon pKa (Strongest Basic) 8.34 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 36.36 Å2 Chemaxon Rotatable Bond Count 2 Chemaxon Refractivity 69.59 m3·mol-1 Chemaxon Polarizability 26.97 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
- Not Available
Drug created at November 18, 2007 18:26 / Updated at September 28, 2023 05:47