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MCULE-1581003458-0
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 | 99 USD | 95 | 19 working days | Get Quote |
| 5 mg | 177 USD | 95 | 19 working days | Get Quote |
| 10 mg | 254 USD | 95 | 19 working days | Get Quote |
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1
MCULE-1171400880-0
- Component type: Main
-
1
MCULE-1113222985-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1581003458-0.sdf |
| SMILES | MCULE-1581003458-0.smiles |
| Standard InChI | MCULE-1581003458-0.inchi |
| InChIKey | MCULE-1581003458-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-591113706 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-887322113 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-871076649 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-853427278 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-851779341 | AmBeed | On request | N/A | Main component as a main component | by synthesis |
| P-596926594 | Angene | Building Blocks in stock | 95 | Main component as a main component | 2.5 g |
| P-864242319 | AstaTech | Backordered BBs | 95 | Main component as a main component | by synthesis |
| P-580451179 | CliniSciences S.A.S | All products | 99 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 408.517 |
| logP | 2.8369 |
| H-bond acceptors | 8 |
| H-bond donors | 4 |
| Rotatable bonds | 6 |
| PSA | 150.64 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 114.018 |
| Atoms | 56 |
| Rings | 3 |
| Heavy atoms | 28 |
| Hydrogen atoms | 28 |
| Heteroatoms | 9 |
| N/O atoms | 8 |
| 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 |
