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MCULE-5878731697
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.
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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 | 42 USD | 97 | 16 working days | Get Quote |
| 5 mg | 42 USD | 97 | 16 working days | Get Quote |
| 10 mg | 42 USD | 97 | 16 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-2924867217
- Component type: Main
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MCULE-2254340198
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5878731697.sdf |
| SMILES | MCULE-5878731697.smiles |
| Standard InChI | MCULE-5878731697.inchi |
| InChIKey | MCULE-5878731697.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-890239404 | BLD pharm | In-stock building blocks | 95 | As is | 2 g |
| P-851287677 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-889410815 | FluoroChem | General BB | 95 | As is | in stock |
| P-864003543 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-597016739 | AEchem | Building blocks | 97 | As a main component | in stock |
| P-591120006 | BLD pharm | Non-stock building blocks | 95 | As a main component | by synthesis |
| P-580723040 | BLD pharm | In-stock building blocks | 97 | As a main component | 6.85 g |
| P-851316000 | Chemshuttle | On request catalog | 95 | As a main component | by synthesis |
| P-861509256 | Combi-Blocks | Building Block on demand | 95 | As a main component | by synthesis |
| P-862122883 | FluoroChem | General BB | N/A | As a main component | in stock |
| P-854797683 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 180.204 |
| logP | 1.5047 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 89.34 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.9056 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
