This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- Soticlestat
- DrugBank Accession Number
- DB16987
- Background
Not Available
- Type
- Small Molecule
- Groups
- Investigational
- Structure
Structure for Soticlestat (DB16987)
- Weight
- Average: 373.456
Monoisotopic: 373.179026993 - Chemical Formula
- C23H23N3O2
- Synonyms
- Not Available
- External IDs
- OV-935
- OV935
- TAK-935
- TAK935
Pharmacology
- Indication
Not Available
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Prevent Adverse Drug Events TodayTap into our Clinical API for life-saving information on contraindications & blackbox warnings, population restrictions, harmful risks, & more.Avoid life-threatening adverse drug events with our Clinical API- 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
Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.- Toxicity
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
Categories
- Drug Categories
- Classification
- Not classified
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- 1766MU795L
- CAS number
- 1429505-03-2
- InChI Key
- XKUZMIUSBMCVPP-UHFFFAOYSA-N
- InChI
- InChI=1S/C23H23N3O2/c27-22(20-7-4-12-25-21(20)19-8-13-24-14-9-19)26-15-10-23(28,11-16-26)17-18-5-2-1-3-6-18/h1-9,12-14,28H,10-11,15-17H2
- IUPAC Name
- 4-benzyl-1-{[2,4'-bipyridine]-3-carbonyl}piperidin-4-ol
- SMILES
- OC1(CC2=CC=CC=C2)CCN(CC1)C(=O)C1=CC=CN=C1C1=CC=NC=C1
References
- General References
- Not Available
- External Links
- ChemSpider
- 68007185
- ChEMBL
- CHEMBL4298172
- PDBe Ligand
- YBS
- PDB Entries
- 7lrl
Clinical Trials
- Clinical Trials
Phase Status Purpose Conditions Count 3 Active Not Recruiting Treatment Dravet Syndrome (DS) 1 3 Completed Treatment Lennox-Gastaut Syndrome 1 3 Recruiting Treatment Dravet Syndrome (DS) / Lennox-Gastaut Syndrome 1 2 Active Not Recruiting Treatment Dravet Syndrome (DS) / Epilepsy / Lennox-Gastaut Syndrome 1 2 Completed Treatment CDKL5 Deficiency Disease / Dup15Q Syndrome 1
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
Property Value Source Water Solubility 0.071 mg/mL ALOGPS logP 2.11 ALOGPS logP 2.12 Chemaxon logS -3.7 ALOGPS pKa (Strongest Acidic) 14.58 Chemaxon pKa (Strongest Basic) 3.91 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 66.32 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 108.36 m3·mol-1 Chemaxon Polarizability 40.62 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
Spectrum Spectrum Type Splash Key Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Not Available
Drug created at September 16, 2022 23:17 / Updated at December 01, 2022 11:33