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MCULE-2104934813-0
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 | 36 USD | 100 | 12 working days | Get Quote |
| 5 mg | 43 USD | 98 | 16 working days | Get Quote |
| 10 mg | 71 USD | 98 | 16 working days | Get Quote |
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1
MCULE-3954867969-0
- Component type: Main
-
1
MCULE-3867000095-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2104934813-0.sdf |
| SMILES | MCULE-2104934813-0.smiles |
| Standard InChI | MCULE-2104934813-0.inchi |
| InChIKey | MCULE-2104934813-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1270477525 | 95 | Main component | by synthesis |
| P-1268923357 | 95 | Main component | by synthesis |
| P-894613370 | 95 | Main component | by resynthesis (? - ? days) |
| P-1264051136 | 100 | Main component | in stock |
| P-851875218 | N/A | Main component | by synthesis |
| P-611096846 | 95 | Main component | by synthesis |
| P-901447454 | 95 | Main component | by synthesis |
| P-855912003 | 95 | Main component | 5 mg |
| P-608273320 | 98 | Main component | in stock |
| P-611442358 | 90 | Main component | in stock |
| P-851655096 | N/A | Main component as a main component | by synthesis |
| P-611056810 | 97 | Main component as a main component | by synthesis |
| P-901522877 | 95 | Main component as a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 434.438 |
| logP | -0.2245 |
| H-bond acceptors | 12 |
| H-bond donors | 7 |
| Rotatable bonds | 10 |
| PSA | 216.71 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 102.5991 |
| Atoms | 60 |
| Rings | 1 |
| Heavy atoms | 30 |
| Hydrogen atoms | 30 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 5 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
