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MCULE-1205060576-0
Structure
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- InChIKey:
- SMILES:
- InChI:
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| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
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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 | 44 USD | 98 | 22 working days | Get Quote |
| 5 mg | 44 USD | 98 | 22 working days | Get Quote |
| 10 mg | 69 USD | 98 | 22 working days | Get Quote |
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MCULE-2683376468-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1205060576-0.sdf |
| SMILES | MCULE-1205060576-0.smiles |
| Standard InChI | MCULE-1205060576-0.inchi |
| InChIKey | MCULE-1205060576-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869357766 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-864181369 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-861345329 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-888621397 | Key Organics | Building Blocks | 95 | As a main component | 5 mg |
| P-584615136 | MedKoo | In stock compounds | 95 | As a main component | in stock |
| P-888173377 | Molnova | On demand | 98 | As a main component | by synthesis |
| P-888633049 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869117904 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-868525044 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 288.302 |
| logP | 0.5007 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 92.67 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 76.5124 |
| Atoms | 37 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 16 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
