5K Scaffold Library
MCE 5K Scaffold Library consists of 5,000 lead-like compounds. Each compound represents one unique scaffold. All compounds are compatible with Lipinski’s rule (Rule of 5) with multiple characteristics such as calculated good solubility (-3.2 < logP < 5), oral bioavailability (RotB <= 10), drug transportability (PSA < 120). Compounds contained within the library have been screened to remove any inappropriate chemical structures, avoiding “false hits”. The sufficient diverse of compound structure makes this library a powerful tool for drug screening.
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In-stock
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Description & Advantages
• Maximum structural diversity.
• Each compound represents one unique scaffold. 5,000 unique scaffods (Bemis-Murcko) totally.
• Compatible with Lipinski’s rule (Rule of 5), with multiple characteristics such as calculated good solubility (-3.2 < logP < 5), oral bioavailability (RotB <= 10), drug transportability (PSA < 120), MW between 300 to 500, number of Hydrogen Bond Donor (HBD) ≤ 5, number of Hydrogen Bond Acceptor (HBA) ≤ 10.
• Passed all associated MedChem filters, particularly pan assay interference compound (PAINS) motifs, to remove any inappropriate chemical structures and avoid false hits.
• All 5,000 compounds are available off the shelf. Pre-plates of 10 mM DMSO solutions, convenient to use.
• NMR and HPLC validated to ensure high purity and quality.
Product Details
A collection of 5,000 lead-like compounds supplied as pre-dissolved DMSO solutions.
Solution: 4,999 compounds supplied in 10 mM solution.
96- or 384-well Plate with Peelable Foil Seal; 96-well Format Sample Storage Tube With Screw Cap and Optional 2D Barcode.
Documentation
- Excel
- SDF