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MCULE-6886621982
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 | 13 USD | 99 | 15 working days | Get Quote |
| 5 mg | 40 USD | 99 | 14 working days | Get Quote |
| 10 mg | 70 USD | 99 | 14 working days | Get Quote |
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1
MCULE-2643038354
- Component type: Main
-
2
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6886621982.sdf |
| SMILES | MCULE-6886621982.smiles |
| Standard InChI | MCULE-6886621982.inchi |
| InChIKey | MCULE-6886621982.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1264055447 | 99 | As is | in stock |
| P-579712581 | 98 | As is | in stock |
| P-1264050546 | 98 | Main component | in stock |
| P-854705139 | 95 | Main component | by synthesis |
| P-903120998 | 99 | Main component as a main component | 3 g |
| P-580726780 | 99 | Main component as a main component | 2.045 g |
| P-862392441 | 95 | Main component as a main component | by synthesis |
| P-861371041 | 95 | Main component as a main component | by synthesis |
| P-889730414 | 98 | Main component as a main component | by synthesis |
| P-579479634 | 95 | Main component as a main component | in stock |
| P-854719043 | 95 | Main component as a main component | in stock |
| P-871072918 | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 465.434 |
| logP | 6.6929 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 84.57 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 133.3967 |
| Atoms | 56 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 26 |
| Heteroatoms | 7 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
