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MCULE-1236145589-0
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 | 31 USD | 90 | 18 working days | Get Quote |
| 5 mg | 31 USD | 90 | 18 working days | Get Quote |
| 10 mg | 31 USD | 90 | 18 working days | Get Quote |
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1
MCULE-2934575538-1
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1236145589-0.sdf |
| SMILES | MCULE-1236145589-0.smiles |
| Standard InChI | MCULE-1236145589-0.inchi |
| InChIKey | MCULE-1236145589-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-617596270 | 90 | As is | 13.92 g |
| P-1270435851 | 95 | Main component | by synthesis |
| P-1268879195 | 95 | Main component | by synthesis |
| P-889866469 | 95 | Main component | by synthesis |
| P-870658428 | N/A | Main component as a main component | in stock |
| P-855911049 | 95 | Main component as a main component | 25 g |
| P-855967017 | 95 | Main component as a main component | 10 g |
| P-854768806 | 95 | Main component as a main component | by synthesis |
| P-617709214 | 90 | Main component as a main component | 131 mg |
| P-617681248 | 90 | Main component as a main component | 131 mg |
| P-889866472 | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 347.654 |
| logP | 3.5258 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 79.82 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 71.0068 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 16 |
| Heteroatoms | 7 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 4 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 4 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
