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MCULE-7804068322
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 | 20 USD | 98 | 16 working days | Get Quote |
| 5 mg | 20 USD | 98 | 16 working days | Get Quote |
| 10 mg | 23 USD | 98 | 26 working days | Get Quote |
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1
MCULE-4789699486
- Component type: Main
-
1
MCULE-1113222985
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7804068322.sdf |
| SMILES | MCULE-7804068322.smiles |
| Standard InChI | MCULE-7804068322.inchi |
| InChIKey | MCULE-7804068322.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-489107335 | 97 | As is | in stock |
| P-871220184 | N/A | As is | by resynthesis (? - ? days) |
| P-887106175 | 98 | As is | in stock |
| P-1275598734 | 95 | As is | by synthesis |
| P-854720985 | 95 | As is | in stock |
| P-474021110 | 95 | As is | in stock |
| P-608277312 | 98 | As is | in stock |
| P-1263957407 | 90 | As is | in stock |
| P-893442736 | 90 | Main component as a main component | 423.821 g |
| P-901407262 | 98 | Main component as a main component | 100 g |
| P-854711665 | 95 | Main component as a main component | in stock |
| P-1263153986 | 95 | Main component as a main component | by synthesis |
| P-579710041 | 98 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 401.837 |
| logP | 3.9082 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 87.07 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 109.3156 |
| Atoms | 48 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 20 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
