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MCULE-1796500823
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 | 50 USD | 95 | 13 working days | Get Quote |
| 5 mg | 63 USD | 95 | 13 working days | Get Quote |
| 10 mg | 69 USD | 98 | 14 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-4086432588
- Component type: Main
-
1
MCULE-1504889908
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1796500823.sdf |
| SMILES | MCULE-1796500823.smiles |
| Standard InChI | MCULE-1796500823.inchi |
| InChIKey | MCULE-1796500823.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-903076926 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 20 mg |
| P-900155323 | AvaChem Scientific | In stock | 95 | As is | in stock |
| P-861344655 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-579477632 | DC Chemicals Limited | Stock Products | 95 | Main component | in stock |
| P-896628159 | MedChemExpress | Screening compounds on demand | 95 | Main component | by synthesis |
| P-901030205 | MedChemExpress | Natural Products on demand | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 676.818 |
| logP | 4.1656 |
| H-bond acceptors | 12 |
| H-bond donors | 4 |
| Rotatable bonds | 10 |
| PSA | 182.52 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 183.2372 |
| Atoms | 95 |
| Rings | 6 |
| Heavy atoms | 47 |
| Hydrogen atoms | 48 |
| Heteroatoms | 13 |
| N/O atoms | 12 |
| 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 |
