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MCULE-6945913404
Compound
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- 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 | 34 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 55 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6945913404.sdf |
| SMILES | MCULE-6945913404.smiles |
| Standard InChI | MCULE-6945913404.inchi |
| InChIKey | MCULE-6945913404.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892989815 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867695469 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-860643517 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-892782542 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893447998 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 10.7 g |
| P-851938500 | AmBeed | In stock | N/A | As is | in stock |
| P-851572421 | AmBeed | On request | N/A | As is | by synthesis |
| P-881625549 | AmBeed | On request | N/A | As is | by synthesis |
| P-865939425 | Angene | Building Blocks in stock | 98 | As is | 7.7 g |
| P-889581138 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-675344298 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502501742 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503472813 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-502830801 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-855955756 | Key Organics | Building Blocks | 97 | As is | 250 mg |
| P-856065462 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 2.3 g |
| P-18944969 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-502378810 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611582475 | Toronto Research | In stock | 90 | As is | in stock |
| P-507697 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 600 mg |
| P-868515865 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 185.177 |
| logP | -0.5761 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 66.84 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 47.8498 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 11 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
