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UNKNOWN STEREO
MCULE-4277055558-0
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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 9 USD | 98 | 20 working days | Get Quote |
| 10 mg | 9 USD | 98 | 20 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-6073202286-0
- Component type: Main
-
1
MCULE-5889111640-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4277055558-0.sdf |
| SMILES | MCULE-4277055558-0.smiles |
| Standard InChI | MCULE-4277055558-0.inchi |
| InChIKey | MCULE-4277055558-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-505550490 | 95 | As is | in stock |
| P-875703774 | N/A | Main component | in stock |
| P-881672487 | 95 | Main component | in stock |
| P-505393668 | 98 | Main component | in stock |
| P-580246041 | 95 | Main component | by synthesis |
| P-596939907 | 98 | Main component | 500 g |
| P-864102051 | 95 | Main component | in stock |
| P-893222793 | 95 | Main component | in stock |
| P-611410311 | 90 | Main component | in stock |
| P-611413681 | 90 | Main component | in stock |
| P-852198693 | N/A | Main component as a main component | by synthesis |
| P-875783884 | N/A | Main component as a main component | in stock |
| P-869183890 | 95 | Main component as a main component | in stock |
| P-505395387 | 97 | Main component as a main component | in stock |
| P-865917536 | 98 | Main component as a main component | 1000 g |
| P-889578966 | 95 | Main component as a main component | in stock |
| P-893251966 | 95 | Main component as a main component | by synthesis |
| P-505517903 | 95 | Main component as a main component | in stock |
| P-611410288 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 502.599 |
| logP | 4.4704 |
| H-bond acceptors | 9 |
| H-bond donors | 5 |
| Rotatable bonds | 14 |
| PSA | 159.18 |
| RO5 violations | 1 |
| RO3 violations | 6 |
| Refractivity | 137.2335 |
| Atoms | 74 |
| Rings | 2 |
| Heavy atoms | 36 |
| Hydrogen atoms | 38 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
