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MCULE-3580882039
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.
|
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 | 28 USD | 98 | 16 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 38 USD | 98 | 8 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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2
MCULE-4644241756
- Component type: Main
-
1
MCULE-3549142744
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3580882039.sdf |
| SMILES | MCULE-3580882039.smiles |
| Standard InChI | MCULE-3580882039.inchi |
| InChIKey | MCULE-3580882039.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-580697347 | BLD pharm | In-stock building blocks | 98 | As is | 2.45 g |
| P-868621785 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-579476721 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-854714246 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-608272944 | Molnova | Stock | 98 | As is | in stock |
| P-620800738 | Alinda | Building Blocks | 95 | Main component | in stock |
| P-500414662 | AvaChem Scientific | On demand | 95 | Main component | by synthesis |
| P-580697346 | BLD pharm | In-stock building blocks | 98 | Main component | 1.4 g |
| P-674291038 | ChemDiv | Building Blocks in stock | 90 | Main component | in stock |
| P-851266845 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861490834 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-854720882 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-896627608 | MedChemExpress | Screening compounds on demand | 95 | Main component | by synthesis |
| P-896070524 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-878639875 | Molnova | Stock | 98 | Main component | in stock |
| P-617403245 | Selleckchem | Product Catalog | N/A | Main component | in stock |
| P-610959648 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component as a main component | 10.433 g |
| P-591052609 | BLD pharm | Non-stock building blocks | 99 | Main component as a main component | by synthesis |
| P-851278294 | Chemshuttle | On request catalog | 95 | Main component as a main component | by synthesis |
| P-861524854 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
| P-852535008 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-895191330 | MedChemExpress | Screening compounds on demand | 95 | Main component as a main component | by synthesis |
| P-895191331 | MedChemExpress | Screening compounds on demand | 95 | Main component as a main component | by synthesis |
| P-474020715 | MedKoo | In stock compounds | 95 | Main component as a main component | in stock |
| P-579710736 | Selleckchem | Product Catalog | N/A | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 1219.587 |
| logP | 9.8818 |
| H-bond acceptors | 22 |
| H-bond donors | 10 |
| Rotatable bonds | 42 |
| PSA | 366.86 |
| RO5 violations | 4 |
| RO3 violations | 6 |
| Refractivity | 336.2962 |
| Atoms | 196 |
| Rings | 2 |
| Heavy atoms | 86 |
| Hydrogen atoms | 110 |
| Heteroatoms | 22 |
| N/O atoms | 22 |
| 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 | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
