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MCULE-5509854160-0
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 | 35 USD | 90 | 17 working days | Get Quote |
| 5 mg | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 working days | Get Quote |
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1
MCULE-2634111558-0
- Component type: Main
-
1
MCULE-4094049864-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5509854160-0.sdf |
| SMILES | MCULE-5509854160-0.smiles |
| Standard InChI | MCULE-5509854160-0.inchi |
| InChIKey | MCULE-5509854160-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-675062579 | Alinda | Stock Screening Compounds | 90 | Main component | in stock |
| P-888497315 | TimTec | ActiMol 4 Week - On demand | 94 | Main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 437.555 |
| logP | 3.5785 |
| H-bond acceptors | 8 |
| H-bond donors | 4 |
| Rotatable bonds | 6 |
| PSA | 127.35 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 122.157 |
| Atoms | 61 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 31 |
| Heteroatoms | 9 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
