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MCULE-5971825603-0
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 | 29 USD | 95 | 34 working days | Get Quote |
| 5 mg | 29 USD | 95 | 34 working days | Get Quote |
| 10 mg | 29 USD | 95 | 34 working days | Get Quote |
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1
MCULE-2740137066-0
- Component type: Main
-
2
MCULE-3169739755-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5971825603-0.sdf |
| SMILES | MCULE-5971825603-0.smiles |
| Standard InChI | MCULE-5971825603-0.inchi |
| InChIKey | MCULE-5971825603-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893618064 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 75.5 g |
| P-505576185 | Bosche Scientific | Bosche Products | 98 | As is | in stock |
| P-851278285 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861428818 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-579480829 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-854713901 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-896630174 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-474022412 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608278159 | Molnova | Stock | 98 | As is | in stock |
| P-579710677 | Selleckchem | Product Catalog | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 1243.481 |
| logP | 11.3261 |
| H-bond acceptors | 20 |
| H-bond donors | 0 |
| Rotatable bonds | 28 |
| PSA | 257.6 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 336.2398 |
| Atoms | 169 |
| Rings | 8 |
| Heavy atoms | 87 |
| Hydrogen atoms | 82 |
| Heteroatoms | 22 |
| N/O atoms | 20 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
