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MCULE-2077919807-3
Structure
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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.
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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.
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|
|---|---|---|---|---|
| 1 mg | 9 USD | 99 | 20 working days | Get Quote |
| 5 mg | 9 USD | 99 | 20 working days | Get Quote |
| 10 mg | 9 USD | 99 | 20 working days | Get Quote |
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MCULE-8319840019-0
- Component type: Main
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MCULE-8534376696-2
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2077919807-3.sdf |
| SMILES | MCULE-2077919807-3.smiles |
| Standard InChI | MCULE-2077919807-3.inchi |
| InChIKey | MCULE-2077919807-3.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-851443227 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-596974022 | Angene | Building Blocks in stock | 99 | As a main component | 405 mg |
| P-591151827 | BLD pharm | Non-stock building blocks | 95 | As a main component | by synthesis |
| P-590597228 | BLD pharm | In-stock building blocks | 98 | As a main component | 405 mg |
| P-855920827 | Key Organics | Building Blocks | 97 | As a main component | 250 mg |
| P-888638954 | TargetMol | Screening Compounds | 95 | As a main component | by synthesis |
| P-869125357 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | in stock |
| P-855354349 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-480858112 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 471.423 |
| logP | -1.5165 |
| H-bond acceptors | 14 |
| H-bond donors | 5 |
| Rotatable bonds | 11 |
| PSA | 225.5 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 122.6367 |
| Atoms | 55 |
| Rings | 3 |
| Heavy atoms | 34 |
| Hydrogen atoms | 21 |
| Heteroatoms | 14 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
