Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6457158959
Compound
Show structures
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 | 14 USD | 98 | 20 working days | Get Quote |
| 5 mg | 14 USD | 98 | 20 working days | Get Quote |
| 10 mg | 14 USD | 98 | 20 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-6457158959.sdf |
| SMILES | MCULE-6457158959.smiles |
| Standard InChI | MCULE-6457158959.inchi |
| InChIKey | MCULE-6457158959.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867559967 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875719860 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-579779168 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-893512417 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 2.44463 kg |
| P-866101071 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | 4.3 g |
| P-517165462 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-436450066 | Alinda | Building Blocks | 95 | As is | in stock |
| P-617064542 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-892509177 | AmBeed | In stock | N/A | As is | in stock |
| P-489145642 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596987323 | Angene | Building Blocks in stock | 98 | As is | 110 g |
| P-866721641 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864176563 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-893279056 | BLD pharm | In-stock building blocks | 98 | As is | 132.7 g |
| P-492247193 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-504703814 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 85 | As is | 5 mg |
| P-619933900 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-454681779 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-5134100 | ChemDiv | Discovery Chemistry Library | 90 | As is | 1 mg |
| P-436442055 | Chemical Block | Building Blocks | 90 | As is | 95.5 g |
| P-289303 | Chemical Block | Screening Library | 90 | As is | 864 mg |
| P-851284573 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-896543968 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-868649703 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34714658 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-862028970 | FluoroChem | General BB | 98 | As is | in stock |
| P-505526691 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492232548 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502945735 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-503247258 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-454378816 | Key Organics | Building Blocks | 95 | As is | 82.579 g |
| P-18794043 | Key Organics | Screening Compounds and Fragments | 95 | As is | 82.579 g |
| P-579619865 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-460587661 | Life Chemicals | Screening Compounds | 90 | As is | 11 mg |
| P-588255008 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852404898 | Matrix Scientific | All | N/A | As is | in stock |
| P-863715197 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-12893231 | Otava | In-House Stock Library | 90 | As is | 49 mg |
| P-500402689 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-424837941 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-24057183 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885523046 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-12302665 | Specs | Screening Compounds | 90 | As is | 1.766 g |
| P-33483918 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502336689 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-873218984 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22560943 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 2 mg |
| P-611456963 | Toronto Research | In stock | 90 | As is | in stock |
| P-1435392 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.1 g |
| P-2372449 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 123 mg |
| P-3221453 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.1 g |
| P-667019479 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.208 |
| logP | 1.5121 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 72.31 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 57.6475 |
| Atoms | 26 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 10 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
