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MCULE-4802680094
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 | 72 USD | 97 | 10 working days | Get Quote |
| 5 mg | 89 USD | 97 | 10 working days | Get Quote |
| 10 mg | 110 USD | 90 | 17 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-3298823805
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4802680094.sdf |
| SMILES | MCULE-4802680094.smiles |
| Standard InChI | MCULE-4802680094.inchi |
| InChIKey | MCULE-4802680094.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-454356986 | 97 | As is | 939 mg |
| P-454422761 | 97 | As is | 939 mg |
| P-852484381 | N/A | As is | in stock |
| P-869019399 | 95 | As is | by synthesis |
| P-893087448 | N/A | Main component | by synthesis |
| P-894663610 | 95 | Main component | in stock |
| P-851894980 | N/A | Main component | by synthesis |
| P-591033877 | 97 | Main component | by synthesis |
| P-577155106 | 90 | Main component | by synthesis |
| P-502535844 | 95 | Main component | by synthesis |
| P-579681835 | 95 | Main component | by resynthesis (? - ? days) |
| P-899775426 | 90 | Main component | 129 mg |
| P-854925415 | 95 | Main component | by synthesis |
| P-491079354 | 95 | Main component | by synthesis |
| P-519877873 | 90 | Main component | in stock |
| P-502378822 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 279.763 |
| logP | 3.6428 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 50.95 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 80.4617 |
| Atoms | 37 |
| Rings | 3 |
| Heavy atoms | 19 |
| Hydrogen atoms | 18 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
