Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5279860443
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 8 USD | 98 | 8 working days | Get Quote |
| 5 mg | 8 USD | 98 | 8 working days | Get Quote |
| 10 mg | 8 USD | 98 | 8 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
| Name | File |
|---|---|
| SDF | MCULE-5279860443.sdf |
| SMILES | MCULE-5279860443.smiles |
| Standard InChI | MCULE-5279860443.inchi |
| InChIKey | MCULE-5279860443.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867568657 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875728447 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869305649 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-903057729 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 300 g |
| P-893481633 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 553.09 g |
| P-866097091 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | 300 mg |
| P-580239266 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-875894306 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-606918844 | AmBeed | In stock | N/A | As is | in stock |
| P-596948352 | Angene | Building Blocks in stock | 97 | As is | 300 g |
| P-494337715 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864094067 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580704178 | BLD pharm | In-stock building blocks | 98 | As is | 56.25 g |
| P-893229416 | Biosynth | In Stock | 95 | As is | in stock |
| P-454624434 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-436467099 | Chemical Intelligence Co Limited | Building Blocks | 95 | As is | in stock |
| P-851245166 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868591966 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-861984391 | FluoroChem | General BB | N/A | As is | in stock |
| P-505534097 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502586702 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-454393168 | Key Organics | Building Blocks | 95 | As is | 197.151 g |
| P-18811609 | Key Organics | Screening Compounds and Fragments | 95 | As is | 197.15 g |
| P-579620722 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-580509422 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852415676 | Matrix Scientific | All | N/A | As is | in stock |
| P-854734374 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888861194 | PharmaBlock | In stock | N/A | As is | in stock |
| P-889870626 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-896085004 | Specs | Repurposed Compounds | N/A | As is | 1.091 g |
| P-596767851 | Synthonix | In-stock Building Blocks | 97 | As is | 272.5 g |
| P-611456516 | Toronto Research | In stock | 90 | As is | in stock |
| P-615401021 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 268.106 |
| logP | 3.1071 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 42.09 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 62.0852 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
