Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4752023957
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 | 35 USD | 95 | 14 working days | Get Quote |
| 5 mg | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 14 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.
-
1
MCULE-9107319494
- Component type: Main
-
1
MCULE-6647815245
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4752023957.sdf |
| SMILES | MCULE-4752023957.smiles |
| Standard InChI | MCULE-4752023957.inchi |
| InChIKey | MCULE-4752023957.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867660651 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875829705 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-874644206 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-19948459 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-436451617 | Alinda | Building Blocks | 95 | Main component | 7 g |
| P-851836678 | AmBeed | On request | N/A | Main component | by synthesis |
| P-489178635 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-870024853 | Asinex | General screening catalog | 90 | Main component | 736 mg |
| P-596503780 | Asinex | General bb catalog | 90 | Main component | 736 mg |
| P-889816028 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-619934574 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-851245462 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-887082646 | Combi-Blocks | Building Block in stock | 95 | Main component | in stock |
| P-580423520 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-861951692 | FluoroChem | General BB | 98 | Main component | in stock |
| P-588710549 | Key Organics | Building Blocks | 97 | Main component | unavailable |
| P-580502505 | Manchester Organics | Compounds on demand | N/A | Main component | by synthesis |
| P-852388096 | Matrix Scientific | All | N/A | Main component | in stock |
| P-519759366 | Maybridge | Maybridge Building Blocks | 97 | Main component | 45.3 g |
| P-428054311 | Maybridge | Screening Collection | 97 | Main component | 45.3 kg |
| P-854841076 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-502390722 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-33610255 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| P-611560326 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893799683 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| P-893721634 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component | by synthesis |
| P-575310551 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-612854835 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-875845027 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-869245700 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-893442512 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component as a main component | 15 g |
| P-872944106 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-851692435 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-489235372 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component as a main component | in stock |
| P-889462802 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-590941195 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| P-611110543 | BLD pharm | Non-stock building blocks | 97 | Main component as a main component | by synthesis |
| P-861377274 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-861506657 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-862059194 | FluoroChem | General BB | 95 | Main component as a main component | in stock |
| P-855951633 | Key Organics | Building Blocks | 95 | Main component as a main component | 1000 mg |
| P-524200606 | Key Organics | Building Blocks | 95 | Main component as a main component | 250 mg |
| P-852489304 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-895271055 | MedChemExpress | Building Blocks on demand | 95 | Main component as a main component | by synthesis |
| P-611533210 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-893665972 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-886932807 | eNovation Chemicals LLC | Building Block on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 218.250 |
| logP | 0.2232 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 103.86 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.439 |
| Atoms | 33 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 18 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
