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MCULE-5063176543-0
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.
|
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 | 81 USD | 95 | 10 working days | Get Quote |
| 5 mg | 81 USD | 95 | 10 working days | Get Quote |
| 10 mg | 81 USD | 95 | 10 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-6220492581-0
- Component type: Main
-
1
MCULE-8865188741-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5063176543-0.sdf |
| SMILES | MCULE-5063176543-0.smiles |
| Standard InChI | MCULE-5063176543-0.inchi |
| InChIKey | MCULE-5063176543-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-489203441 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-591094650 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-489199274 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-494326499 | Apollo Scientific | In Stock | 95 | Main component | in stock |
| P-591178979 | BLD pharm | Non-stock building blocks | 97 | Main component | by synthesis |
| P-851251280 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861548453 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-852523831 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854815622 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-591131397 | BLD pharm | Non-stock building blocks | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 405.289 |
| logP | 3.3021 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 7 |
| PSA | 106.86 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 79.8751 |
| Atoms | 44 |
| Rings | 1 |
| Heavy atoms | 27 |
| Hydrogen atoms | 17 |
| Heteroatoms | 12 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 6 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
